[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: (4-hydroxycyclohexyl)-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C2CCC(CC2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]C2CCC(CC2)O)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-10-3-4-12(9-15(10)17(19)20)11(2)16-13-5-7-14(18)8-6-13/h3-4,9,11,13-14,16,18H,5-8H2,1-2H3/p+1/t11-,13?,14?/m0/s1