[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 3-pyrrol-1-ylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 3-pyrrol-1-ylbenzoate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C26H22N2O3/c29-25(27-24-14-5-4-11-21(24)17-20-9-2-1-3-10-20)19-31-26(30)22-12-8-13-23(18-22)28-15-6-7-16-28/h1-16,18H,17,19H2,(H,27,29)