1-[(3-pyridin-4-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(3-pyridin-4-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Openeye Name: 1-[[3-(4-pyridyl)phenyl]methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine CAS Name: 1-[(3-pyridin-4-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3-pyridin-4-ylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Traditional Name: 1-[3-(4-pyridyl)benzyl]-4-(2,3,4-trimethoxybenzyl)piperazine Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C4=CC=NC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C4=CC=NC=C4)OC)OC

InChI

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