(3-nitrophenyl)methyl-(4-oxidanylcyclohexyl)azanium

Systemtic Name: (3-nitrophenyl)methyl-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(3-nitrophenyl)methyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(3-nitrophenyl)methyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(3-nitrophenyl)methyl]azanium Traditional Name: (4-hydroxycyclohexyl)-(3-nitrobenzyl)ammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CCC1[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H18N2O3/c16-13-6-4-11(5-7-13)14-9-10-2-1-3-12(8-10)15(17)18/h1-3,8,11,13-14,16H,4-7,9H2/p+1