ethyl (5E)-5-[(E)-3-azanyl-2-cyano-3-[(4-methoxyphenyl)methylamino]prop-2-enylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[(E)-3-azanyl-2-cyano-3-[(4-methoxyphenyl)methylamino]prop-2-enylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(E)-3-amino-2-cyano-3-[(4-methoxyphenyl)methylamino]prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-5-[(E)-3-amino-2-cyano-3-[(4-methoxyphenyl)methylamino]prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(E)-3-amino-2-cyano-3-[(4-methoxyphenyl)methylamino]prop-2-enylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-5-[(E)-3-amino-2-cyano-3-(p-anisylamino)prop-2-enylidene]-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC(=C(N)NCC2=CC=C(C=C2)OC)C#N)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C/C(=C(/N)\NCC2=CC=C(C=C2)OC)/C#N)/C1=O)C

InChI

InChI=1S/C20H22N4O4/c1-4-28-20(26)17-12(2)24-16(18(17)25)9-14(10-21)19(22)23-11-13-5-7-15(27-3)8-6-13/h5-9,23-24H,4,11,22H2,1-3H3/b16-9+,19-14+