1-[(2,6-dimethoxyphenyl)-pyridin-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-pyridin-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,6-dimethoxyphenyl)-pyridin-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-pyridyl)methyl]-1,4-diazepane Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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