5-[(Z)-2-cyano-3-[(4-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-benzoate

Systemtic Name: 5-[(Z)-2-cyano-3-[(4-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-benzoate Openeye Name: 5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxo-prop-1-enyl]-2-methoxy-benzoate CAS Name: 5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoate IUPAC Name: 5-[(Z)-2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-methoxybenzoate Traditional Name: 5-[(Z)-2-cyano-3-(4-ethylanilino)-3-keto-prop-1-enyl]-2-methoxy-benzoate Formula: C20H17N2O4- MolecularWeight: 349.35998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)C(=O)[O-])C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC(=C(C=C2)OC)C(=O)[O-])/C#N

InChI

InChI=1S/C20H18N2O4/c1-3-13-4-7-16(8-5-13)22-19(23)15(12-21)10-14-6-9-18(26-2)17(11-14)20(24)25/h4-11H,3H2,1-2H3,(H,22,23)(H,24,25)/p-1/b15-10-