[(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitro-phenyl)propyl]azanium

Systemtic Name: [(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitro-phenyl)propyl]azanium Openeye Name: [(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitro-phenyl)propyl]ammonium CAS Name: [(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitrophenyl)propyl]ammonium IUPAC Name: [(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitrophenyl)propyl]azanium Traditional Name: [(1R)-3-cyclohexyl-1-(3,4-dimethyl-5-nitro-phenyl)propyl]ammonium Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(CCC2CCCCC2)[NH3+])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)[C@@H](CCC2CCCCC2)[NH3+])[N+](=O)[O-])C

InChI

InChI=1S/C17H26N2O2/c1-12-10-15(11-17(13(12)2)19(20)21)16(18)9-8-14-6-4-3-5-7-14/h10-11,14,16H,3-9,18H2,1-2H3/p+1/t16-/m1/s1