4,5-bis(hydroxymethyl)-2-methyl-pyridin-3-ol; 1-[(4-chlorophenyl)-phenyl-methyl]-4-[(3-methylphenyl)methyl]piperazine; trihydrochloride

Systemtic Name: 4,5-bis(hydroxymethyl)-2-methyl-pyridin-3-ol; 1-[(4-chlorophenyl)-phenyl-methyl]-4-[(3-methylphenyl)methyl]piperazine; trihydrochloride Openeye Name: 4,5-bis(hydroxymethyl)-2-methyl-pyridin-3-ol; 1-[(4-chlorophenyl)-phenyl-methyl]-4-(m-tolylmethyl)piperazine; trihydrochloride CAS Name: 4,5-bis(hydroxymethyl)-2-methyl-3-pyridinol; 1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine; trihydrochloride IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol; 1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine; trihydrochloride Traditional Name: 1-[(4-chlorophenyl)-phenyl-methyl]-4-(3-methylbenzyl)piperazine; 2-methyl-4,5-dimethylol-pyridin-3-ol; trihydrochloride Formula: C33H41Cl4N3O3 MolecularWeight: 669.50894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.CC1=NC=C(C(=C1O)CO)CO.Cl.Cl.Cl

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.CC1=NC=C(C(=C1O)CO)CO.Cl.Cl.Cl

InChI

InChI=1S/C25H27ClN2.C8H11NO3.3ClH/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23;1-5-8(12)7(4-11)6(3-10)2-9-5;;;/h2-13,18,25H,14-17,19H2,1H3;2,10-12H,3-4H2,1H3;3*1H