1-[(5-bromanyl-2-methoxy-phenyl)-(5-methylpyridin-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-(5-methylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-(5-methyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-methoxyphenyl)-(5-methyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-(5-methylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-(5-methyl-2-pyridyl)methyl]-1,4-diazepane Formula: C19H24BrN3O MolecularWeight: 390.31736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24BrN3O/c1-14-4-6-17(22-13-14)19(23-10-3-8-21-9-11-23)16-12-15(20)5-7-18(16)24-2/h4-7,12-13,19,21H,3,8-11H2,1-2H3