[(3S)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-propan-2-yl-azanium

Systemtic Name: [(3S)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-propan-2-yl-azanium Openeye Name: [(3S)-1-[(2-fluoro-5-methoxy-phenyl)methyl]-3-hydroxy-2-oxo-3-piperidyl]methyl-isopropyl-ammonium CAS Name: [(3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-2-oxo-3-piperidinyl]methyl-propan-2-ylammonium IUPAC Name: [(3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-2-oxopiperidin-3-yl]methyl-propan-2-ylazanium Traditional Name: [(3S)-1-(2-fluoro-5-methoxy-benzyl)-3-hydroxy-2-keto-3-piperidyl]methyl-isopropyl-ammonium Formula: C17H26FN2O3+ MolecularWeight: 325.398343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC1(CCCN(C1=O)CC2=C(C=CC(=C2)OC)F)O

Isomeric SMILES

CC(C)[NH2+]C[C@]1(CCCN(C1=O)CC2=C(C=CC(=C2)OC)F)O

InChI

InChI=1S/C17H25FN2O3/c1-12(2)19-11-17(22)7-4-8-20(16(17)21)10-13-9-14(23-3)5-6-15(13)18/h5-6,9,12,19,22H,4,7-8,10-11H2,1-3H3/p+1/t17-/m0/s1