(2Z)-2-[4-[(4-nitrophenyl)methoxycarbonyl]cyclohexyl]oxyimino-3-oxidanylidene-butanoic acid

Systemtic Name: (2Z)-2-[4-[(4-nitrophenyl)methoxycarbonyl]cyclohexyl]oxyimino-3-oxidanylidene-butanoic acid Openeye Name: (2Z)-2-[4-[(4-nitrophenyl)methoxycarbonyl]cyclohexoxy]imino-3-oxo-butanoic acid CAS Name: (2Z)-2-[4-[(4-nitrophenyl)methoxy-oxomethyl]cyclohexyl]oxyimino-3-oxobutanoic acid IUPAC Name: (2Z)-2-[4-[(4-nitrophenyl)methoxycarbonyl]cyclohexyl]oxyimino-3-oxobutanoic acid Traditional Name: (2Z)-3-keto-2-[4-(4-nitrobenzyl)oxycarbonylcyclohexyl]oximino-butyric acid Formula: C18H20N2O8 MolecularWeight: 392.36

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NOC1CCC(CC1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(=O)/C(=N/OC1CCC(CC1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)O

InChI

InChI=1S/C18H20N2O8/c1-11(21)16(17(22)23)19-28-15-8-4-13(5-9-15)18(24)27-10-12-2-6-14(7-3-12)20(25)26/h2-3,6-7,13,15H,4-5,8-10H2,1H3,(H,22,23)/b19-16-