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

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(2,5-dimethoxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2,5-dimethoxyphenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,5-dimethoxyphenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(2,5-dimethoxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C19H25N3O2 MolecularWeight: 327.4207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=CC=CC=N2)N3CCCNCC3

InChI

InChI=1S/C19H25N3O2/c1-23-15-7-8-18(24-2)16(14-15)19(17-6-3-4-10-21-17)22-12-5-9-20-11-13-22/h3-4,6-8,10,14,19-20H,5,9,11-13H2,1-2H3