cyanomethyl 2,5-dimethyl-1-(2-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: cyanomethyl 2,5-dimethyl-1-(2-methylphenyl)pyrrole-3-carboxylate Openeye Name: cyanomethyl 2,5-dimethyl-1-(o-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(2-methylphenyl)-3-pyrrolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2,5-dimethyl-1-(2-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(o-tolyl)pyrrole-3-carboxylic acid cyanomethyl ester Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=C2C)C(=O)OCC#N)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=C2C)C(=O)OCC#N)C

InChI

InChI=1S/C16H16N2O2/c1-11-6-4-5-7-15(11)18-12(2)10-14(13(18)3)16(19)20-9-8-17/h4-7,10H,9H2,1-3H3