2-[(4-chlorophenyl)-pyridin-2-yl-methyl]-1,4-diazepane

Systemtic Name: 2-[(4-chlorophenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 2-[(4-chlorophenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 2-[(4-chlorophenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 2-[(4-chlorophenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 2-[(4-chlorophenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C17H20ClN3 MolecularWeight: 301.8138

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(NC1)C(C2=CC=C(C=C2)Cl)C3=CC=CC=N3

Isomeric SMILES

C1CNCC(NC1)C(C2=CC=C(C=C2)Cl)C3=CC=CC=N3

InChI

InChI=1S/C17H20ClN3/c18-14-7-5-13(6-8-14)17(15-4-1-2-10-20-15)16-12-19-9-3-11-21-16/h1-2,4-8,10,16-17,19,21H,3,9,11-12H2