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

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2,3-dimethoxyphenyl)-(3-methyl-4-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2,3-dimethoxyphenyl)-(3-methyl-4-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,3-dimethoxyphenyl)-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Traditional Name: 1-[(2,3-dimethoxyphenyl)-(3-methyl-4-pyridyl)methyl]-1,4-diazepane Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCNCC3

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCNCC3

InChI

InChI=1S/C20H27N3O2/c1-15-14-22-10-8-16(15)19(23-12-5-9-21-11-13-23)17-6-4-7-18(24-2)20(17)25-3/h4,6-8,10,14,19,21H,5,9,11-13H2,1-3H3