methyl 4-[(E)-3-butoxy-2-cyano-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-butoxy-2-cyano-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-butoxy-2-cyano-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-butoxy-2-cyano-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-butoxy-2-cyano-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-butoxy-2-cyano-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC=C(C=C1)C(=O)OC)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC=C(C=C1)C(=O)OC)/C#N

InChI

InChI=1S/C16H17NO4/c1-3-4-9-21-16(19)14(11-17)10-12-5-7-13(8-6-12)15(18)20-2/h5-8,10H,3-4,9H2,1-2H3/b14-10+