methyl 4-[5-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-[5-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: methyl 4-[5-[(E)-2-cyano-3-(methylamino)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-cyano-3-keto-3-(methylamino)prop-1-enyl]-2-furyl]benzoic acid methyl ester Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=CC=C(O1)C2=CC=C(C=C2)C(=O)OC)/C#N

InChI

InChI=1S/C17H14N2O4/c1-19-16(20)13(10-18)9-14-7-8-15(23-14)11-3-5-12(6-4-11)17(21)22-2/h3-9H,1-2H3,(H,19,20)/b13-9+