(4-bromanyl-3-methyl-phenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium

Systemtic Name: (4-bromanyl-3-methyl-phenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium Openeye Name: (4-bromo-3-methyl-phenyl)-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]ammonium CAS Name: (4-bromo-3-methylphenyl)-[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]ammonium IUPAC Name: (4-bromo-3-methylphenyl)-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]azanium Traditional Name: (4-bromo-3-methyl-phenyl)-[(1S)-2-keto-1-methyl-2-piperidino-ethyl]ammonium Formula: C15H22BrN2O+ MolecularWeight: 326.25198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[NH2+]C(C)C(=O)N2CCCCC2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[NH2+][C@@H](C)C(=O)N2CCCCC2)Br

InChI

InChI=1S/C15H21BrN2O/c1-11-10-13(6-7-14(11)16)17-12(2)15(19)18-8-4-3-5-9-18/h6-7,10,12,17H,3-5,8-9H2,1-2H3/p+1/t12-/m0/s1