methyl 4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-1-prop-2-enyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxidanylidene-1-prop-2-enyl-pyrrole-3-carboxylate Openeye Name: methyl 1-allyl-4-[(4-ethylphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-1-prop-2-enyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-ethylphenyl)methylidene]-2-methyl-5-oxo-1-prop-2-enylpyrrole-3-carboxylate Traditional Name: 1-allyl-4-(4-ethylbenzylidene)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC=C)C)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC=C)C)C(=O)OC

InChI

InChI=1S/C19H21NO3/c1-5-11-20-13(3)17(19(22)23-4)16(18(20)21)12-15-9-7-14(6-2)8-10-15/h5,7-10,12H,1,6,11H2,2-4H3