N-(phenylmethyl)-1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine

Systemtic Name: N-(phenylmethyl)-1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine Openeye Name: N-benzyl-1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]piperidin-4-amine CAS Name: N-(phenylmethyl)-1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]methyl]-4-piperidinamine IUPAC Name: N-benzyl-1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-amine Traditional Name: benzyl-[1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]-4-piperidyl]amine Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN3CCC(CC3)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN3CCC(CC3)NCC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O3/c1-31-25-16-22(17-26(32-2)27(25)33-3)24-15-21(9-12-28-24)19-30-13-10-23(11-14-30)29-18-20-7-5-4-6-8-20/h4-9,12,15-17,23,29H,10-11,13-14,18-19H2,1-3H3