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

Systemtic Name: cyclohexyl-[[(3S)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium Openeye Name: cyclohexyl-[[(3S)-1-[(2-fluoro-5-methoxy-phenyl)methyl]-3-hydroxy-2-oxo-3-piperidyl]methyl]ammonium CAS Name: cyclohexyl-[[(3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-2-oxo-3-piperidinyl]methyl]ammonium IUPAC Name: cyclohexyl-[[(3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-hydroxy-2-oxopiperidin-3-yl]methyl]azanium Traditional Name: cyclohexyl-[[(3S)-1-(2-fluoro-5-methoxy-benzyl)-3-hydroxy-2-keto-3-piperidyl]methyl]ammonium Formula: C20H30FN2O3+ MolecularWeight: 365.462203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)CN2CCCC(C2=O)(C[NH2+]C3CCCCC3)O

Isomeric SMILES

COC1=CC(=C(C=C1)F)CN2CCC[C@@](C2=O)(C[NH2+]C3CCCCC3)O

InChI

InChI=1S/C20H29FN2O3/c1-26-17-8-9-18(21)15(12-17)13-23-11-5-10-20(25,19(23)24)14-22-16-6-3-2-4-7-16/h8-9,12,16,22,25H,2-7,10-11,13-14H2,1H3/p+1/t20-/m0/s1