methyl 3-cyano-2-[(E)-N-(methoxycarbonylamino)-C-methyl-carbonimidoyl]-4-oxidanylidene-3-phenyl-pentanoate

Systemtic Name: methyl 3-cyano-2-[(E)-N-(methoxycarbonylamino)-C-methyl-carbonimidoyl]-4-oxidanylidene-3-phenyl-pentanoate Openeye Name: methyl 3-cyano-2-[(E)-N-(methoxycarbonylamino)-C-methyl-carbonimidoyl]-4-oxo-3-phenyl-pentanoate CAS Name: 3-cyano-2-[(1E)-1-(methoxycarbonylhydrazinylidene)ethyl]-4-oxo-3-phenylpentanoic acid methyl ester IUPAC Name: methyl 3-cyano-2-[(E)-N-(methoxycarbonylamino)-C-methylcarbonimidoyl]-4-oxo-3-phenylpentanoate Traditional Name: 2-[(E)-N-(carbomethoxyamino)-C-methyl-carbonimidoyl]-3-cyano-4-keto-3-phenyl-valeric acid methyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)OC)C(C(=O)OC)C(C#N)(C1=CC=CC=C1)C(=O)C

Isomeric SMILES

C/C(=N\NC(=O)OC)/C(C(=O)OC)C(C#N)(C1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C17H19N3O5/c1-11(19-20-16(23)25-4)14(15(22)24-3)17(10-18,12(2)21)13-8-6-5-7-9-13/h5-9,14H,1-4H3,(H,20,23)/b19-11+