[4-[(3-bromophenyl)methyl]-1,4-diazepan-1-yl]-(6-chloranylpyridin-3-yl)methanone

Systemtic Name: [4-[(3-bromophenyl)methyl]-1,4-diazepan-1-yl]-(6-chloranylpyridin-3-yl)methanone Openeye Name: [4-[(3-bromophenyl)methyl]-1,4-diazepan-1-yl]-(6-chloro-3-pyridyl)methanone CAS Name: [4-[(3-bromophenyl)methyl]-1,4-diazepan-1-yl]-(6-chloro-3-pyridinyl)methanone IUPAC Name: [4-[(3-bromophenyl)methyl]-1,4-diazepan-1-yl]-(6-chloropyridin-3-yl)methanone Traditional Name: [4-(3-bromobenzyl)-1,4-diazepan-1-yl]-(6-chloro-3-pyridyl)methanone Formula: C18H19BrClN3O MolecularWeight: 408.71996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CN=C(C=C2)Cl)CC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CN=C(C=C2)Cl)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H19BrClN3O/c19-16-4-1-3-14(11-16)13-22-7-2-8-23(10-9-22)18(24)15-5-6-17(20)21-12-15/h1,3-6,11-12H,2,7-10,13H2