3-{4-cyano-3-[(2R)-3-{[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino}-2-hydroxypropoxy]phenyl}propanoic acid



Compound number:
MolPort-046-418-188
CAS number: 351490-27-2
IUPAC:
3-{4-cyano-3-[(2R)-3-{[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino}-2-hydroxypropoxy]phenyl}propanoic acid
IUPAC traditional:
3-{4-cyano-3-[(2R)-3-{[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino}-2-hydroxypropoxy]phenyl}propanoic acid
SMILES:
CC(C)(CC1Cc2ccccc2C1)NC[C@@H](O)COc1cc(CCC(O)=O)ccc1C#N |r|
InChI key:
NJBFJCJKWWIKRD-HSZRJFAPSA-N
Molecular formula:
C26H32N2O4
Molecular weight: 436.552
Solubility: not available

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More Information

Compound Identifiers
Compound number: MolPort-046-418-188
CAS number: 351490-27-2

Names, Synonyms and 3rd Party Identifiers
Name: MFCD19443794
SB-423562

InChI
InChI: 1S/C26H32N2O4/c1-26(2,14-19-11-20-5-3-4-6-21(20)12-19)28-16-23(29)17-32-24-13-18(8-10-25(30)31)7-9-22(24)15-27/h3-7,9,13,19,23,28-29H,8,10-12,14,16-17H2,1-2H3,(H,30,31)/t23-/m1/s1
InChI key: NJBFJCJKWWIKRD-HSZRJFAPSA-N

Calculated Properties
Molecular formula: C26H32N2O4
Molecular weight: 436.552

Other

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