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

Systemtic Name: 1-[(2-bromophenyl)-pyridin-4-yl-methyl]-1,4-diazepane Openeye Name: 1-[(2-bromophenyl)-(4-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromophenyl)-pyridin-4-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(2-bromophenyl)-pyridin-4-ylmethyl]-1,4-diazepane Traditional Name: 1-[(2-bromophenyl)-(4-pyridyl)methyl]-1,4-diazepane Formula: C17H20BrN3 MolecularWeight: 346.2648

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=NC=C2)C3=CC=CC=C3Br

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=NC=C2)C3=CC=CC=C3Br

InChI

InChI=1S/C17H20BrN3/c18-16-5-2-1-4-15(16)17(14-6-9-20-10-7-14)21-12-3-8-19-11-13-21/h1-2,4-7,9-10,17,19H,3,8,11-13H2