4-[5-[(E)-2-cyano-3-[(3,5-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: 4-[5-[(E)-2-cyano-3-[(3,5-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: 4-[5-[(E)-2-cyano-3-(3,5-dimethylanilino)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-cyano-3-(3,5-dimethylanilino)-3-oxoprop-1-enyl]-2-furanyl]benzoate IUPAC Name: 4-[5-[(E)-2-cyano-3-(3,5-dimethylanilino)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-cyano-3-(3,5-dimethylanilino)-3-keto-prop-1-enyl]-2-furyl]benzoate Formula: C23H17N2O4- MolecularWeight: 385.39208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)[O-])C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)/C(=C/C2=CC=C(O2)C3=CC=C(C=C3)C(=O)[O-])/C#N)C

InChI

InChI=1S/C23H18N2O4/c1-14-9-15(2)11-19(10-14)25-22(26)18(13-24)12-20-7-8-21(29-20)16-3-5-17(6-4-16)23(27)28/h3-12H,1-2H3,(H,25,26)(H,27,28)/p-1/b18-12+