methyl 3-[3-azanyl-5-(1-methylindol-5-yl)-4-(1-phenylethoxy)phenyl]propanoate

Systemtic Name: methyl 3-[3-azanyl-5-(1-methylindol-5-yl)-4-(1-phenylethoxy)phenyl]propanoate Openeye Name: methyl 3-[3-amino-5-(1-methylindol-5-yl)-4-(1-phenylethoxy)phenyl]propanoate CAS Name: 3-[3-amino-5-(1-methyl-5-indolyl)-4-(1-phenylethoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-amino-5-(1-methylindol-5-yl)-4-(1-phenylethoxy)phenyl]propanoate Traditional Name: 3-[3-amino-5-(1-methylindol-5-yl)-4-(1-phenylethoxy)phenyl]propionic acid methyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2C3=CC4=C(C=C3)N(C=C4)C)CCC(=O)OC)N

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2C3=CC4=C(C=C3)N(C=C4)C)CCC(=O)OC)N

InChI

InChI=1S/C27H28N2O3/c1-18(20-7-5-4-6-8-20)32-27-23(15-19(16-24(27)28)9-12-26(30)31-3)21-10-11-25-22(17-21)13-14-29(25)2/h4-8,10-11,13-18H,9,12,28H2,1-3H3