[2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methyl-3-pyrrol-1-yl-benzoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-methyl-3-pyrrol-1-yl-benzoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 4-methyl-3-pyrrol-1-yl-benzoate CAS Name: 4-methyl-3-(1-pyrrolyl)benzoic acid [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] 4-methyl-3-pyrrol-1-ylbenzoate Traditional Name: 4-methyl-3-pyrrol-1-yl-benzoic acid [2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC(=O)NC)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC(=O)NC)N3C=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-15-10-11-17(14-18(15)25-12-6-7-13-25)21(27)29-19(16-8-4-3-5-9-16)20(26)24-22(28)23-2/h3-14,19H,1-2H3,(H2,23,24,26,28)