(4-methylphenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium

Systemtic Name: (4-methylphenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]-(p-tolyl)ammonium CAS Name: (4-methylphenyl)-[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]ammonium IUPAC Name: (4-methylphenyl)-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-piperidino-ethyl]-(p-tolyl)ammonium Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-12-6-8-14(9-7-12)16-13(2)15(18)17-10-4-3-5-11-17/h6-9,13,16H,3-5,10-11H2,1-2H3/p+1/t13-/m0/s1