(2-methylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-methylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]-(o-tolyl)ammonium CAS Name: (2-methylphenyl)-[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: (2-methylphenyl)-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[(3S)-3-methylpiperidino]ethyl]-(o-tolyl)ammonium Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C[NH2+]C2=CC=CC=C2C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C[NH2+]C2=CC=CC=C2C

InChI

InChI=1S/C15H22N2O/c1-12-6-5-9-17(11-12)15(18)10-16-14-8-4-3-7-13(14)2/h3-4,7-8,12,16H,5-6,9-11H2,1-2H3/p+1/t12-/m0/s1