2-bromanyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-bromanyl-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-bromo-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxo-ethyl]benzamide CAS Name: 2-bromo-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxoethyl]benzamide IUPAC Name: 2-bromo-N-[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-2-oxoethyl]benzamide Traditional Name: 2-bromo-N-[2-keto-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]benzamide Formula: C15H21BrN3O2+ MolecularWeight: 355.25014

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CNC(=O)C2=CC=CC=C2Br

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CNC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C15H20BrN3O2/c1-18-7-4-8-19(10-9-18)14(20)11-17-15(21)12-5-2-3-6-13(12)16/h2-3,5-6H,4,7-11H2,1H3,(H,17,21)/p+1