methyl 4-[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamoyl]benzoate CAS Name: 4-[[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamoyl]benzoate Traditional Name: 4-[[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamoyl]benzoic acid methyl ester Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)C3=CNC4=CC=CC=C43

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H27N3O3/c1-30(2)21-14-12-18(13-15-21)23(24-17-28-25-7-5-4-6-22(24)25)16-29-26(31)19-8-10-20(11-9-19)27(32)33-3/h4-15,17,23,28H,16H2,1-3H3,(H,29,31)