[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: [2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl] (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: [2-(1-methylpyrrol-2-yl)-2-oxo-ethyl] (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid [2-(1-methyl-2-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-methylpyrrol-2-yl)-2-oxoethyl] (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid [2-keto-2-(1-methylpyrrol-2-yl)ethyl] ester Formula: C17H17NO3 MolecularWeight: 283.32178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)OCC(=O)C2=CC=CN2C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)C2=CC=CN2C

InChI

InChI=1S/C17H17NO3/c1-13-5-7-14(8-6-13)9-10-17(20)21-12-16(19)15-4-3-11-18(15)2/h3-11H,12H2,1-2H3/b10-9+