N-phenyl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine dihydrochloride

Systemtic Name: N-phenyl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine dihydrochloride Openeye Name: N-phenyl-N-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]piperidin-4-amine dihydrochloride CAS Name: N-phenyl-N-[[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]methyl]-4-piperidinamine dihydrochloride IUPAC Name: N-phenyl-N-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine dihydrochloride Traditional Name: phenyl-(4-piperidyl)-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]amine dihydrochloride Formula: C26H33Cl2N3O3 MolecularWeight: 506.46452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN(C3CCNCC3)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN(C3CCNCC3)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C26H31N3O3.2ClH/c1-30-24-16-20(17-25(31-2)26(24)32-3)23-15-19(9-14-28-23)18-29(21-7-5-4-6-8-21)22-10-12-27-13-11-22;;/h4-9,14-17,22,27H,10-13,18H2,1-3H3;2*1H