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

Systemtic Name: 1-[(3-methoxyphenyl)-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Openeye Name: 1-[(3-methoxyphenyl)-(3-methyl-4-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methoxyphenyl)-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Traditional Name: 1-[(3-methoxyphenyl)-(3-methyl-4-pyridyl)methyl]-1,4-diazepane Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O/c1-15-14-21-9-7-18(15)19(22-11-4-8-20-10-12-22)16-5-3-6-17(13-16)23-2/h3,5-7,9,13-14,19-20H,4,8,10-12H2,1-2H3