[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]-(4-propan-2-ylphenyl)azanium

Systemtic Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]-(4-propan-2-ylphenyl)azanium Openeye Name: (4-isopropylphenyl)-[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: [2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]-(4-propan-2-ylphenyl)ammonium IUPAC Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]-(4-propan-2-ylphenyl)azanium Traditional Name: [2-keto-2-[(3S)-3-methylpiperidino]ethyl]-p-cumenyl-ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-13(2)15-6-8-16(9-7-15)18-11-17(20)19-10-4-5-14(3)12-19/h6-9,13-14,18H,4-5,10-12H2,1-3H3/p+1/t14-/m0/s1