2-methoxy-4-nitro-6-[(Z)-[[1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-yl]carbonylhydrazinylidene]methyl]phenolate

Systemtic Name: 2-methoxy-4-nitro-6-[(Z)-[[1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-yl]carbonylhydrazinylidene]methyl]phenolate Openeye Name: 2-methoxy-4-nitro-6-[(Z)-[[1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carbonyl]hydrazono]methyl]phenolate CAS Name: 2-methoxy-4-nitro-6-[(Z)-[[[1-[(4-nitrophenyl)methyl]-4-piperidin-1-iumyl]-oxomethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 2-methoxy-4-nitro-6-[(Z)-[[1-[(4-nitrophenyl)methyl]piperidin-1-ium-4-carbonyl]hydrazinylidene]methyl]phenolate Traditional Name: 2-methoxy-4-nitro-6-[(Z)-[[1-(4-nitrobenzyl)piperidin-1-ium-4-carbonyl]hydrazono]methyl]phenolate Formula: C21H23N5O7 MolecularWeight: 457.43662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])C=NNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])/C=N\NC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H23N5O7/c1-33-19-11-18(26(31)32)10-16(20(19)27)12-22-23-21(28)15-6-8-24(9-7-15)13-14-2-4-17(5-3-14)25(29)30/h2-5,10-12,15,27H,6-9,13H2,1H3,(H,23,28)/b22-12-