(2Z)-but-2-enedioic acid; 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[(3-fluorophenyl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one



Compound number:
MolPort-003-983-486
CAS number: 1135278-61-3
IUPAC:
(2Z)-but-2-enedioic acid; 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[(3-fluorophenyl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
IUPAC traditional:
8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[(3-fluorophenyl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one; maleic acid
SMILES:
OC(=O)\C=C/C(O)=O.Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CN(Cc1cccc(F)c1)C2=O)c1ccccc1
InChI key:
JURUFADWVGXLOY-BTJKTKAUSA-N
Molecular formula:
C34H35F2N3O6
Molecular weight: 619.666
Solubility: not available

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More Information

Compound Identifiers
Compound number: MolPort-003-983-486
CAS number: 1135278-61-3

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000003995320
3'-Fluorobenzylspiperone maleate
3'-Fluorobenzylspiperone maleate

InChI
InChI: 1S/C30H31F2N3O2.C4H4O4/c31-25-13-11-24(12-14-25)28(36)10-5-17-33-18-15-30(16-19-33)29(37)34(21-23-6-4-7-26(32)20-23)22-35(30)27-8-2-1-3-9-27;5-3(6)1-2-4(7)8/h1-4,6-9,11-14,20H,5,10,15-19,21-22H2;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChI key: JURUFADWVGXLOY-BTJKTKAUSA-N

Calculated Properties
Molecular formula: C34H35F2N3O6
Molecular weight: 619.666

Other

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