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

Systemtic Name: diethyl (2E)-2-[(3-nitropyridin-2-yl)-(phenylmethyl)hydrazinylidene]hexanedioate Openeye Name: diethyl (2E)-2-[benzyl-(3-nitro-2-pyridyl)hydrazono]hexanedioate CAS Name: (2E)-2-[(3-nitro-2-pyridinyl)-(phenylmethyl)hydrazinylidene]hexanedioic acid diethyl ester IUPAC Name: diethyl (2E)-2-[benzyl-(3-nitropyridin-2-yl)hydrazinylidene]hexanedioate Traditional Name: (2E)-2-[benzyl-(3-nitro-2-pyridyl)hydrazono]adipic acid diethyl ester Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O6/c1-3-31-20(27)14-8-12-18(22(28)32-4-2)24-25(16-17-10-6-5-7-11-17)21-19(26(29)30)13-9-15-23-21/h5-7,9-11,13,15H,3-4,8,12,14,16H2,1-2H3/b24-18+