[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-(1-methylpyrrol-2-yl)-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-(1-methyl-2-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-methylpyrrol-2-yl)-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-keto-2-(1-methylpyrrol-2-yl)ethyl] ester Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=CN2C

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=CN2C

InChI

InChI=1S/C16H16N2O4/c1-11(19)17-13-6-3-5-12(9-13)16(21)22-10-15(20)14-7-4-8-18(14)2/h3-9H,10H2,1-2H3,(H,17,19)