2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol; pyridine-3-carboxylate

Systemtic Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol; pyridine-3-carboxylate Openeye Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol; pyridine-3-carboxylate CAS Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-1-cyclohexanol; 3-pyridinecarboxylate IUPAC Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol; pyridine-3-carboxylate Traditional Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol; nicotinate Formula: C22H29N2O4- MolecularWeight: 385.47666

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCC1(C2=CC(=CC=C2)OC)O.C1=CC(=CN=C1)C(=O)[O-]

Isomeric SMILES

CN(C)CC1CCCCC1(C2=CC(=CC=C2)OC)O.C1=CC(=CN=C1)C(=O)[O-]

InChI

InChI=1S/C16H25NO2.C6H5NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3;8-6(9)5-2-1-3-7-4-5/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3;1-4H,(H,8,9)/p-1