methyl 4-ethanoyl-5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-ethanoyl-5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-acetyl-3-[(E)-3-anilino-3-oxo-prop-1-enyl]-5-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-3-[(E)-3-anilino-3-oxoprop-1-enyl]-5-methyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-acetyl-3-[(E)-3-anilino-3-oxoprop-1-enyl]-5-methyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-3-[(E)-3-anilino-3-keto-prop-1-enyl]-5-methyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)OC)C=CC(=O)NC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)OC)/C=C/C(=O)NC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C18H18N2O4/c1-11-16(12(2)21)14(17(19-11)18(23)24-3)9-10-15(22)20-13-7-5-4-6-8-13/h4-10,19H,1-3H3,(H,20,22)/b10-9+