[(2S)-2-azaniumyl-2-(4-propan-2-yloxyphenyl)ethyl]-cyclohexyl-methyl-azanium

Systemtic Name: [(2S)-2-azaniumyl-2-(4-propan-2-yloxyphenyl)ethyl]-cyclohexyl-methyl-azanium Openeye Name: [(2S)-2-azaniumyl-2-(4-isopropoxyphenyl)ethyl]-cyclohexyl-methyl-ammonium CAS Name: [(2S)-2-ammonio-2-(4-propan-2-yloxyphenyl)ethyl]-cyclohexyl-methylammonium IUPAC Name: [(2S)-2-azaniumyl-2-(4-propan-2-yloxyphenyl)ethyl]-cyclohexyl-methylazanium Traditional Name: [(2S)-2-ammonio-2-(4-isopropoxyphenyl)ethyl]-cyclohexyl-methyl-ammonium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C[NH+](C)C2CCCCC2)[NH3+]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H](C[NH+](C)C2CCCCC2)[NH3+]

InChI

InChI=1S/C18H30N2O/c1-14(2)21-17-11-9-15(10-12-17)18(19)13-20(3)16-7-5-4-6-8-16/h9-12,14,16,18H,4-8,13,19H2,1-3H3/p+2/t18-/m1/s1