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

Systemtic Name: cycloheptyl-[[(3S)-1-[(2-fluorophenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium Openeye Name: cycloheptyl-[[(3S)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidyl]methyl]ammonium CAS Name: cycloheptyl-[[(3S)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidinyl]methyl]ammonium IUPAC Name: cycloheptyl-[[(3S)-1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxopiperidin-3-yl]methyl]azanium Traditional Name: cycloheptyl-[[(3S)-1-(2-fluorobenzyl)-3-hydroxy-2-keto-3-piperidyl]methyl]ammonium Formula: C20H30FN2O2+ MolecularWeight: 349.462803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH2+]CC2(CCCN(C2=O)CC3=CC=CC=C3F)O

Isomeric SMILES

C1CCCC(CC1)[NH2+]C[C@]2(CCCN(C2=O)CC3=CC=CC=C3F)O

InChI

InChI=1S/C20H29FN2O2/c21-18-11-6-5-8-16(18)14-23-13-7-12-20(25,19(23)24)15-22-17-9-3-1-2-4-10-17/h5-6,8,11,17,22,25H,1-4,7,9-10,12-15H2/p+1/t20-/m0/s1