[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C17H17NO4/c1-12-4-6-13(7-5-12)15(19)8-9-17(21)22-11-16(20)14-3-2-10-18-14/h2-7,10,18H,8-9,11H2,1H3