ethyl 3-[4-cyano-3-[3-[2-(2,3-dihydro-1H-inden-1-yl)propan-2-ylamino]-2-oxidanyl-propoxy]phenyl]propanoate

Systemtic Name: ethyl 3-[4-cyano-3-[3-[2-(2,3-dihydro-1H-inden-1-yl)propan-2-ylamino]-2-oxidanyl-propoxy]phenyl]propanoate Openeye Name: ethyl 3-[4-cyano-3-[2-hydroxy-3-[(1-indan-1-yl-1-methyl-ethyl)amino]propoxy]phenyl]propanoate CAS Name: 3-[4-cyano-3-[3-[2-(2,3-dihydro-1H-inden-1-yl)propan-2-ylamino]-2-hydroxypropoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-cyano-3-[3-[2-(2,3-dihydro-1H-inden-1-yl)propan-2-ylamino]-2-hydroxypropoxy]phenyl]propanoate Traditional Name: 3-[4-cyano-3-[2-hydroxy-3-[(1-indan-1-yl-1-methyl-ethyl)amino]propoxy]phenyl]propionic acid ethyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=C(C=C1)C#N)OCC(CNC(C)(C)C2CCC3=CC=CC=C23)O

Isomeric SMILES

CCOC(=O)CCC1=CC(=C(C=C1)C#N)OCC(CNC(C)(C)C2CCC3=CC=CC=C23)O

InChI

InChI=1S/C27H34N2O4/c1-4-32-26(31)14-10-19-9-11-21(16-28)25(15-19)33-18-22(30)17-29-27(2,3)24-13-12-20-7-5-6-8-23(20)24/h5-9,11,15,22,24,29-30H,4,10,12-14,17-18H2,1-3H3