[(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-(3-methylphenyl)azanium

Systemtic Name: [(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-(3-methylphenyl)azanium Openeye Name: [(1S)-2-[(2S)-2-ethyl-1-piperidyl]-1-methyl-2-oxo-ethyl]-(m-tolyl)ammonium CAS Name: [(2S)-1-[(2S)-2-ethyl-1-piperidinyl]-1-oxopropan-2-yl]-(3-methylphenyl)ammonium IUPAC Name: [(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxopropan-2-yl]-(3-methylphenyl)azanium Traditional Name: [(1S)-2-[(2S)-2-ethylpiperidino]-2-keto-1-methyl-ethyl]-(m-tolyl)ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)[NH2+]C2=CC=CC(=C2)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)[C@H](C)[NH2+]C2=CC=CC(=C2)C

InChI

InChI=1S/C17H26N2O/c1-4-16-10-5-6-11-19(16)17(20)14(3)18-15-9-7-8-13(2)12-15/h7-9,12,14,16,18H,4-6,10-11H2,1-3H3/p+1/t14-,16-/m0/s1