[(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate

Systemtic Name: [(3R)-4-azanylidene-3-cyano-2-oxidanylidene-pentyl] 3-(furan-2-ylcarbonylamino)-4-methyl-benzoate Openeye Name: [(3R)-3-cyano-4-imino-2-oxo-pentyl] 3-(furan-2-carbonylamino)-4-methyl-benzoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-4-methylbenzoic acid [(3R)-3-cyano-4-imino-2-oxopentyl] ester IUPAC Name: [(3R)-3-cyano-4-imino-2-oxopentyl] 3-(furan-2-carbonylamino)-4-methylbenzoate Traditional Name: 3-(2-furoylamino)-4-methyl-benzoic acid [(3R)-3-cyano-4-imino-2-keto-pentyl] ester Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)C(C#N)C(=N)C)NC(=O)C2=CC=CO2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)[C@@H](C#N)C(=N)C)NC(=O)C2=CC=CO2

InChI

InChI=1S/C19H17N3O5/c1-11-5-6-13(8-15(11)22-18(24)17-4-3-7-26-17)19(25)27-10-16(23)14(9-20)12(2)21/h3-8,14,21H,10H2,1-2H3,(H,22,24)/t14-/m0/s1