[1-[(6-methyl-1H-indol-4-yl)oxy]-3-(4-phenylbutan-2-ylamino)propan-2-yl] benzoate

Systemtic Name: [1-[(6-methyl-1H-indol-4-yl)oxy]-3-(4-phenylbutan-2-ylamino)propan-2-yl] benzoate Openeye Name: [1-[(6-methyl-1H-indol-4-yl)oxymethyl]-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] benzoate CAS Name: benzoic acid [1-[(6-methyl-1H-indol-4-yl)oxy]-3-(4-phenylbutan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-[(6-methyl-1H-indol-4-yl)oxy]-3-(4-phenylbutan-2-ylamino)propan-2-yl] benzoate Traditional Name: benzoic acid [1-[(6-methyl-1H-indol-4-yl)oxymethyl]-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CN2)C(=C1)OCC(CNC(C)CCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=CN2)C(=C1)OCC(CNC(C)CCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O3/c1-21-17-27-26(15-16-30-27)28(18-21)33-20-25(34-29(32)24-11-7-4-8-12-24)19-31-22(2)13-14-23-9-5-3-6-10-23/h3-12,15-18,22,25,30-31H,13-14,19-20H2,1-2H3