2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol phosphate

Systemtic Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol phosphate Openeye Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol phosphate CAS Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-1-cyclohexanol phosphate IUPAC Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol phosphate Traditional Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol phosphate Formula: C16H25NO6P-3 MolecularWeight: 358.346561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2.H3O4P/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3;1-5(2,3)4/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3;(H3,1,2,3,4)/p-3