N-[[3-chloranyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-piperidin-4-yl-methanamine dihydrochloride

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-piperidin-4-yl-methanamine dihydrochloride Openeye Name: N-[[3-chloro-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl]-1-(4-piperidyl)methanamine dihydrochloride CAS Name: N-[[3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-(4-piperidinyl)methanamine dihydrochloride IUPAC Name: N-[[3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-1-piperidin-4-ylmethanamine dihydrochloride Traditional Name: [3-chloro-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]-(4-piperidylmethyl)amine dihydrochloride Formula: C22H31Cl3N2O2 MolecularWeight: 461.85274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)CNCC3CCNCC3)OC.Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Cl)CNCC3CCNCC3)OC.Cl.Cl

InChI

InChI=1S/C22H29ClN2O2.2ClH/c1-16-3-5-18(6-4-16)15-27-22-20(23)11-19(12-21(22)26-2)14-25-13-17-7-9-24-10-8-17;;/h3-6,11-12,17,24-25H,7-10,13-15H2,1-2H3;2*1H