[(3S)-1-methyl-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1-phenylcyclopropyl)azanium

Systemtic Name: [(3S)-1-methyl-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1-phenylcyclopropyl)azanium Openeye Name: [(3S)-3-hydroxy-1-methyl-2-oxo-3-piperidyl]methyl-(1-phenylcyclopropyl)ammonium CAS Name: [(3S)-3-hydroxy-1-methyl-2-oxo-3-piperidinyl]methyl-(1-phenylcyclopropyl)ammonium IUPAC Name: [(3S)-3-hydroxy-1-methyl-2-oxopiperidin-3-yl]methyl-(1-phenylcyclopropyl)azanium Traditional Name: [(3S)-3-hydroxy-2-keto-1-methyl-3-piperidyl]methyl-(1-phenylcyclopropyl)ammonium Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1=O)(C[NH2+]C2(CC2)C3=CC=CC=C3)O

Isomeric SMILES

CN1CCC[C@@](C1=O)(C[NH2+]C2(CC2)C3=CC=CC=C3)O

InChI

InChI=1S/C16H22N2O2/c1-18-11-5-8-16(20,14(18)19)12-17-15(9-10-15)13-6-3-2-4-7-13/h2-4,6-7,17,20H,5,8-12H2,1H3/p+1/t16-/m0/s1