methyl 2-methyl-5-oxidanylidene-1-prop-2-enyl-4-(pyridin-2-ylmethylidene)pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-5-oxidanylidene-1-prop-2-enyl-4-(pyridin-2-ylmethylidene)pyrrole-3-carboxylate Openeye Name: methyl 1-allyl-2-methyl-5-oxo-4-(2-pyridylmethylene)pyrrole-3-carboxylate CAS Name: 2-methyl-5-oxo-1-prop-2-enyl-4-(2-pyridinylmethylidene)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-oxo-1-prop-2-enyl-4-(pyridin-2-ylmethylidene)pyrrole-3-carboxylate Traditional Name: 1-allyl-5-keto-2-methyl-4-(2-pyridylmethylene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=CC=N2)C(=O)N1CC=C)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC2=CC=CC=N2)C(=O)N1CC=C)C(=O)OC

InChI

InChI=1S/C16H16N2O3/c1-4-9-18-11(2)14(16(20)21-3)13(15(18)19)10-12-7-5-6-8-17-12/h4-8,10H,1,9H2,2-3H3