[(1S)-2-[(4-bromophenyl)carbonylamino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-bromophenyl)carbonylamino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-bromobenzoyl)amino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-bromophenyl)-oxomethyl]amino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-bromobenzoyl)amino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-bromobenzoyl)amino]-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]-dimethyl-ammonium Formula: C21H27BrN3O+ MolecularWeight: 417.36258

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C1C=CC(=C2)C(CNC(=O)C3=CC=C(C=C3)Br)[NH+](C)C

Isomeric SMILES

CN1CCCC2=C1C=CC(=C2)[C@@H](CNC(=O)C3=CC=C(C=C3)Br)[NH+](C)C

InChI

InChI=1S/C21H26BrN3O/c1-24(2)20(14-23-21(26)15-6-9-18(22)10-7-15)17-8-11-19-16(13-17)5-4-12-25(19)3/h6-11,13,20H,4-5,12,14H2,1-3H3,(H,23,26)/p+1/t20-/m1/s1