1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]-1,4-diazepane

Systemtic Name: 1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]-1,4-diazepane Openeye Name: 1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]-1,4-diazepane CAS Name: 1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]methyl]-1,4-diazepane IUPAC Name: 1-[[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]methyl]-1,4-diazepane Traditional Name: 1-[[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]methyl]-1,4-diazepane Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN3CCCNCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2)CN3CCCNCC3

InChI

InChI=1S/C20H27N3O3/c1-24-18-12-16(13-19(25-2)20(18)26-3)17-11-15(5-7-22-17)14-23-9-4-6-21-8-10-23/h5,7,11-13,21H,4,6,8-10,14H2,1-3H3