[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-pyrrol-1-ylbenzoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-pyrrol-1-ylbenzoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=CN3

Isomeric SMILES

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=CN3

InChI

InChI=1S/C17H14N2O3/c20-16(15-7-4-8-18-15)12-22-17(21)13-5-3-6-14(11-13)19-9-1-2-10-19/h1-11,18H,12H2