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

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(3-methylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-methyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-methyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(3-methylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-methyl-2-pyridyl)methyl]-1,4-diazepane Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=C(C=CC=C2OC)OC)N3CCCNCC3

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=C(C=CC=C2OC)OC)N3CCCNCC3

InChI

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