[6-[(3-bromophenyl)amino]-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-[(3-bromophenyl)amino]-6-oxidanylidene-hexyl]azanium Openeye Name: [6-(3-bromoanilino)-6-oxo-hexyl]ammonium CAS Name: [6-(3-bromoanilino)-6-oxohexyl]ammonium IUPAC Name: [6-(3-bromoanilino)-6-oxohexyl]azanium Traditional Name: [6-(3-bromoanilino)-6-keto-hexyl]ammonium Formula: C12H18BrN2O+ MolecularWeight: 286.18812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)CCCCC[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)CCCCC[NH3+]

InChI

InChI=1S/C12H17BrN2O/c13-10-5-4-6-11(9-10)15-12(16)7-2-1-3-8-14/h4-6,9H,1-3,7-8,14H2,(H,15,16)/p+1