ethyl 5-[(E)-3-butoxy-2-cyano-3-oxidanylidene-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(E)-3-butoxy-2-cyano-3-oxidanylidene-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(E)-3-butoxy-2-cyano-3-oxo-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-3-butoxy-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-3-butoxy-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-3-butoxy-2-cyano-3-keto-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=C(C(=C(N1)C)C(=O)OCC)C)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=C(C(=C(N1)C)C(=O)OCC)C)/C#N

InChI

InChI=1S/C17H22N2O4/c1-5-7-8-23-16(20)13(10-18)9-14-11(3)15(12(4)19-14)17(21)22-6-2/h9,19H,5-8H2,1-4H3/b13-9+