butanoate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol

Systemtic Name: butanoate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol Openeye Name: butanoate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol CAS Name: butanoate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-1-cyclohexanol IUPAC Name: butanoate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol Traditional Name: butyrate; 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol Formula: C21H34NO4- MolecularWeight: 364.49896

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O

Isomeric SMILES

CCCC(=O)[O-].CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O

InChI

InChI=1S/C17H27NO2.C4H8O2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14;1-2-3-4(5)6/h7-10,16,19H,4-6,11-13H2,1-3H3;2-3H2,1H3,(H,5,6)/p-1