5-(4-chlorophenyl)-1-pyridin-2-yl-1,4-diazepane

Systemtic Name: 5-(4-chlorophenyl)-1-pyridin-2-yl-1,4-diazepane Openeye Name: 5-(4-chlorophenyl)-1-(2-pyridyl)-1,4-diazepane CAS Name: 5-(4-chlorophenyl)-1-(2-pyridinyl)-1,4-diazepane IUPAC Name: 5-(4-chlorophenyl)-1-pyridin-2-yl-1,4-diazepane Traditional Name: 5-(4-chlorophenyl)-1-(2-pyridyl)-1,4-diazepane Formula: C16H18ClN3 MolecularWeight: 287.78722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNC1C2=CC=C(C=C2)Cl)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCNC1C2=CC=C(C=C2)Cl)C3=CC=CC=N3

InChI

InChI=1S/C16H18ClN3/c17-14-6-4-13(5-7-14)15-8-11-20(12-10-18-15)16-3-1-2-9-19-16/h1-7,9,15,18H,8,10-12H2