diethyl (2E)-2-[(3-nitropyridin-2-yl)-(phenylmethyl)hydrazinylidene]pentanedioate

Systemtic Name: diethyl (2E)-2-[(3-nitropyridin-2-yl)-(phenylmethyl)hydrazinylidene]pentanedioate Openeye Name: diethyl (2E)-2-[benzyl-(3-nitro-2-pyridyl)hydrazono]pentanedioate CAS Name: (2E)-2-[(3-nitro-2-pyridinyl)-(phenylmethyl)hydrazinylidene]pentanedioic acid diethyl ester IUPAC Name: diethyl (2E)-2-[benzyl-(3-nitropyridin-2-yl)hydrazinylidene]pentanedioate Traditional Name: (2E)-2-[benzyl-(3-nitro-2-pyridyl)hydrazono]glutaric acid diethyl ester Formula: C21H24N4O6 MolecularWeight: 428.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=NN(CC1=CC=CC=C1)C2=C(C=CC=N2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)CC/C(=N\N(CC1=CC=CC=C1)C2=C(C=CC=N2)[N+](=O)[O-])/C(=O)OCC

InChI

InChI=1S/C21H24N4O6/c1-3-30-19(26)13-12-17(21(27)31-4-2)23-24(15-16-9-6-5-7-10-16)20-18(25(28)29)11-8-14-22-20/h5-11,14H,3-4,12-13,15H2,1-2H3/b23-17+