5-(3,5-dimethoxy-4-methyl-phenyl)-1-pyridin-2-yl-1,4-diazepane

Systemtic Name: 5-(3,5-dimethoxy-4-methyl-phenyl)-1-pyridin-2-yl-1,4-diazepane Openeye Name: 5-(3,5-dimethoxy-4-methyl-phenyl)-1-(2-pyridyl)-1,4-diazepane CAS Name: 5-(3,5-dimethoxy-4-methylphenyl)-1-(2-pyridinyl)-1,4-diazepane IUPAC Name: 5-(3,5-dimethoxy-4-methylphenyl)-1-pyridin-2-yl-1,4-diazepane Traditional Name: 5-(3,5-dimethoxy-4-methyl-phenyl)-1-(2-pyridyl)-1,4-diazepane Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C2CCN(CCN2)C3=CC=CC=N3)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C2CCN(CCN2)C3=CC=CC=N3)OC

InChI

InChI=1S/C19H25N3O2/c1-14-17(23-2)12-15(13-18(14)24-3)16-7-10-22(11-9-20-16)19-6-4-5-8-21-19/h4-6,8,12-13,16,20H,7,9-11H2,1-3H3