ethyl 4-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]phenyl]butanoate

Systemtic Name: ethyl 4-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]phenyl]butanoate Openeye Name: ethyl 4-[4-cyano-3-[(2R)-2-hydroxy-3-[(2-indan-2-yl-1,1-dimethyl-ethyl)amino]propoxy]phenyl]butanoate CAS Name: 4-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]phenyl]butanoate Traditional Name: 4-[4-cyano-3-[(2R)-2-hydroxy-3-[(2-indan-2-yl-1,1-dimethyl-ethyl)amino]propoxy]phenyl]butyric acid ethyl ester Formula: C29H38N2O4 MolecularWeight: 478.62302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=CC(=C(C=C1)C#N)OCC(CNC(C)(C)CC2CC3=CC=CC=C3C2)O

Isomeric SMILES

CCOC(=O)CCCC1=CC(=C(C=C1)C#N)OC[C@@H](CNC(C)(C)CC2CC3=CC=CC=C3C2)O

InChI

InChI=1S/C29H38N2O4/c1-4-34-28(33)11-7-8-21-12-13-25(18-30)27(16-21)35-20-26(32)19-31-29(2,3)17-22-14-23-9-5-6-10-24(23)15-22/h5-6,9-10,12-13,16,22,26,31-32H,4,7-8,11,14-15,17,19-20H2,1-3H3/t26-/m1/s1