[(1S)-2-azaniumyl-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(2,4-dimethylphenyl)ethyl]-cyclohexyl-methyl-ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C[NH3+])[NH+](C)C2CCCCC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@@H](C[NH3+])[NH+](C)C2CCCCC2)C

InChI

InChI=1S/C17H28N2/c1-13-9-10-16(14(2)11-13)17(12-18)19(3)15-7-5-4-6-8-15/h9-11,15,17H,4-8,12,18H2,1-3H3/p+2/t17-/m1/s1