[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)CCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)CCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H26N2O3/c30-26(29-24-14-6-4-11-21(24)17-20-9-2-1-3-10-20)19-32-27(31)16-8-12-22-18-28-25-15-7-5-13-23(22)25/h1-7,9-11,13-15,18,28H,8,12,16-17,19H2,(H,29,30)