[3-[(4-bromophenyl)amino]-3-oxidanylidene-propyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [3-[(4-bromophenyl)amino]-3-oxidanylidene-propyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-(4-bromoanilino)-3-oxo-propyl]-methyl-ammonium CAS Name: [3-(4-bromoanilino)-3-oxopropyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-(4-bromoanilino)-3-oxopropyl]-methylazanium Traditional Name: benzyl-[3-(4-bromoanilino)-3-keto-propyl]-methyl-ammonium Formula: C17H20BrN2O+ MolecularWeight: 348.2575

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=CC=C(C=C1)Br)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCC(=O)NC1=CC=C(C=C1)Br)CC2=CC=CC=C2

InChI

InChI=1S/C17H19BrN2O/c1-20(13-14-5-3-2-4-6-14)12-11-17(21)19-16-9-7-15(18)8-10-16/h2-10H,11-13H2,1H3,(H,19,21)/p+1