[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(2-bromophenyl)azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(2-bromophenyl)azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-(2-bromophenyl)ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-(2-bromophenyl)ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-(2-bromophenyl)azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-(2-bromophenyl)ammonium Formula: C14H20BrN2O+ MolecularWeight: 312.2254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH2+]C2=CC=CC=C2Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH2+]C2=CC=CC=C2Br

InChI

InChI=1S/C14H19BrN2O/c15-12-7-3-4-8-13(12)16-11-14(18)17-9-5-1-2-6-10-17/h3-4,7-8,16H,1-2,5-6,9-11H2/p+1