[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(furan-2-ylmethylamino)benzoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(furan-2-ylmethylamino)benzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(2-furylmethylamino)benzoate CAS Name: 2-(2-furanylmethylamino)benzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(furan-2-ylmethylamino)benzoate Traditional Name: 2-(2-furfurylamino)benzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CC=CC=C1NCC2=CC=CO2)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC=CC=C1NCC2=CC=CO2)/N

InChI

InChI=1S/C18H17N3O4/c1-12(20)15(9-19)17(22)11-25-18(23)14-6-2-3-7-16(14)21-10-13-5-4-8-24-13/h2-8,21H,10-11,20H2,1H3/b15-12+