(3,5-dimethylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3,5-dimethylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: (3,5-dimethylphenyl)-[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: (3,5-dimethylphenyl)-[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: (3,5-dimethylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]azanium Traditional Name: (3,5-dimethylphenyl)-[2-keto-2-[(3S)-3-methylpiperidino]ethyl]ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C[NH2+]C2=CC(=CC(=C2)C)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C[NH2+]C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C16H24N2O/c1-12-5-4-6-18(11-12)16(19)10-17-15-8-13(2)7-14(3)9-15/h7-9,12,17H,4-6,10-11H2,1-3H3/p+1/t12-/m0/s1