(2,5-dimethylphenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium

Systemtic Name: (2,5-dimethylphenyl)-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]azanium Openeye Name: (2,5-dimethylphenyl)-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]ammonium CAS Name: (2,5-dimethylphenyl)-[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]ammonium IUPAC Name: (2,5-dimethylphenyl)-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]azanium Traditional Name: (2,5-dimethylphenyl)-[(1S)-2-keto-1-methyl-2-piperidino-ethyl]ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O/c1-12-7-8-13(2)15(11-12)17-14(3)16(19)18-9-5-4-6-10-18/h7-8,11,14,17H,4-6,9-10H2,1-3H3/p+1/t14-/m0/s1