2-[(4-nitro-1-oxidanyl-pyridin-2-ylidene)amino]propyl 2-(3-oxidanylidene-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate

Systemtic Name: 2-[(4-nitro-1-oxidanyl-pyridin-2-ylidene)amino]propyl 2-(3-oxidanylidene-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate Openeye Name: 2-[(1-hydroxy-4-nitro-2-pyridylidene)amino]propyl 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)peroxyacetate CAS Name: 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoic acid 2-[(1-hydroxy-4-nitro-2-pyridinylidene)amino]propyl ester IUPAC Name: 2-[(1-hydroxy-4-nitropyridin-2-ylidene)amino]propyl 2-(3-oxo-1,2,4,5-tetrahydro-2-benzazepin-4-yl)ethaneperoxoate Traditional Name: 2-(3-keto-1,2,4,5-tetrahydro-2-benzazepin-4-yl)peracetic acid 2-[(1-hydroxy-4-nitro-2-pyridylidene)amino]propyl ester Formula: C20H22N4O7 MolecularWeight: 430.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(COOC(=O)CC1CC2=CC=CC=C2CNC1=O)N=C3C=C(C=CN3O)[N+](=O)[O-]

Isomeric SMILES

CC(COOC(=O)CC1CC2=CC=CC=C2CNC1=O)N=C3C=C(C=CN3O)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O7/c1-13(22-18-10-17(24(28)29)6-7-23(18)27)12-30-31-19(25)9-16-8-14-4-2-3-5-15(14)11-21-20(16)26/h2-7,10,13,16,27H,8-9,11-12H2,1H3,(H,21,26)