(2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methyl-pentan-3-ol; hydrogen phosphate

Systemtic Name: (2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methyl-pentan-3-ol; hydrogen phosphate Openeye Name: (2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methyl-pentan-3-ol; hydrogen phosphate CAS Name: (2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methyl-3-pentanol; hydrogen phosphate IUPAC Name: (2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methylpentan-3-ol; hydrogen phosphate Traditional Name: (2S,3S)-1-(dimethylamino)-3-(3-methoxyphenyl)-2-methyl-pentan-3-ol; hydrogen phosphate Formula: C30H51N2O8P-2 MolecularWeight: 598.708301

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)OC)(C(C)CN(C)C)O.CCC(C1=CC(=CC=C1)OC)(C(C)CN(C)C)O.OP(=O)([O-])[O-]

Isomeric SMILES

CC[C@@](C1=CC(=CC=C1)OC)([C@@H](C)CN(C)C)O.CC[C@@](C1=CC(=CC=C1)OC)([C@@H](C)CN(C)C)O.OP(=O)([O-])[O-]

InChI

InChI=1S/2C15H25NO2.H3O4P/c2*1-6-15(17,12(2)11-16(3)4)13-8-7-9-14(10-13)18-5;1-5(2,3)4/h2*7-10,12,17H,6,11H2,1-5H3;(H3,1,2,3,4)/p-2/t2*12-,15-;/m00./s1