[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H14N2O4/c1-11(15(19)18-10-14-6-3-7-21-14)22-16(20)13-5-2-4-12(8-13)9-17/h2-8,11H,10H2,1H3,(H,18,19)