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

Systemtic Name: (4-bromanyl-3-methyl-phenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium Openeye Name: (4-bromo-3-methyl-phenyl)-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: (4-bromo-3-methylphenyl)-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]ammonium IUPAC Name: (4-bromo-3-methylphenyl)-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]azanium Traditional Name: (4-bromo-3-methyl-phenyl)-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethyl]ammonium Formula: C14H20BrN2O+ MolecularWeight: 312.2254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[NH2+]C(C)C(=O)N2CCCC2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[NH2+][C@@H](C)C(=O)N2CCCC2)Br

InChI

InChI=1S/C14H19BrN2O/c1-10-9-12(5-6-13(10)15)16-11(2)14(18)17-7-3-4-8-17/h5-6,9,11,16H,3-4,7-8H2,1-2H3/p+1/t11-/m0/s1