1-[(1S)-2-[dimethyl(oxidanyl)azaniumyl]-1-(4-methoxyphenyl)ethyl]cyclohexan-1-olate

Systemtic Name: 1-[(1S)-2-[dimethyl(oxidanyl)azaniumyl]-1-(4-methoxyphenyl)ethyl]cyclohexan-1-olate Openeye Name: 1-[(1S)-2-[hydroxy(dimethyl)ammonio]-1-(4-methoxyphenyl)ethyl]cyclohexanolate CAS Name: 1-[(1S)-2-[hydroxy(dimethyl)ammonio]-1-(4-methoxyphenyl)ethyl]-1-cyclohexanolate IUPAC Name: 1-[(1S)-2-[hydroxy(dimethyl)azaniumyl]-1-(4-methoxyphenyl)ethyl]cyclohexan-1-olate Traditional Name: 1-[(1S)-2-[hydroxy(dimethyl)ammonio]-1-(4-methoxyphenyl)ethyl]cyclohexanolate Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(C1=CC=C(C=C1)OC)C2(CCCCC2)[O-])O

Isomeric SMILES

C[N+](C)(C[C@H](C1=CC=C(C=C1)OC)C2(CCCCC2)[O-])O

InChI

InChI=1S/C17H27NO3/c1-18(2,20)13-16(17(19)11-5-4-6-12-17)14-7-9-15(21-3)10-8-14/h7-10,16,20H,4-6,11-13H2,1-3H3/t16-/m1/s1