[7-[(3-bromophenyl)amino]-7-oxidanylidene-heptyl]azanium

Systemtic Name: [7-[(3-bromophenyl)amino]-7-oxidanylidene-heptyl]azanium Openeye Name: [7-(3-bromoanilino)-7-oxo-heptyl]ammonium CAS Name: [7-(3-bromoanilino)-7-oxoheptyl]ammonium IUPAC Name: [7-(3-bromoanilino)-7-oxoheptyl]azanium Traditional Name: [7-(3-bromoanilino)-7-keto-heptyl]ammonium Formula: C13H20BrN2O+ MolecularWeight: 300.2147

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrN2O/c14-11-6-5-7-12(10-11)16-13(17)8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,15H2,(H,16,17)/p+1