(1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol

Systemtic Name: (1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol Openeye Name: (1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol CAS Name: (1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol IUPAC Name: (1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol Traditional Name: (1S,3R,6S)-6-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexane-1,3-diol Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCC(CC1(C2=CC(=CC=C2)OC)O)O

Isomeric SMILES

CN(C)C[C@@H]1CC[C@H](C[C@]1(C2=CC(=CC=C2)OC)O)O

InChI

InChI=1S/C16H25NO3/c1-17(2)11-13-7-8-14(18)10-16(13,19)12-5-4-6-15(9-12)20-3/h4-6,9,13-14,18-19H,7-8,10-11H2,1-3H3/t13-,14+,16+/m0/s1