1-[5-(4-chloranyl-3,5-dimethoxy-phenyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1-[5-(4-chloranyl-3,5-dimethoxy-phenyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-[5-(4-chloro-3,5-dimethoxy-phenyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-[5-(4-chloro-3,5-dimethoxyphenyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-[5-(4-chloro-3,5-dimethoxyphenyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-[5-(4-chloro-3,5-dimethoxy-phenyl)-2-pyridyl]-1,4-diazepane Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Cl)OC)C2=CN=C(C=C2)N3CCCNCC3

Isomeric SMILES

COC1=CC(=CC(=C1Cl)OC)C2=CN=C(C=C2)N3CCCNCC3

InChI

InChI=1S/C18H22ClN3O2/c1-23-15-10-14(11-16(24-2)18(15)19)13-4-5-17(21-12-13)22-8-3-6-20-7-9-22/h4-5,10-12,20H,3,6-9H2,1-2H3