ethyl 3,5-dimethyl-4-[(E)-3-(2-methylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[(E)-3-(2-methylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[(E)-3-(o-tolyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[(E)-3-(2-methylphenyl)-1-oxoprop-2-enyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[(E)-3-(2-methylphenyl)prop-2-enoyl]-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[(E)-3-(o-tolyl)acryloyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)C=CC2=CC=CC=C2C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)/C=C/C2=CC=CC=C2C)C

InChI

InChI=1S/C19H21NO3/c1-5-23-19(22)18-13(3)17(14(4)20-18)16(21)11-10-15-9-7-6-8-12(15)2/h6-11,20H,5H2,1-4H3/b11-10+