3-[1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]ethylsulfanyl]-2-nitro-phenol

Systemtic Name: 3-[1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]ethylsulfanyl]-2-nitro-phenol Openeye Name: 3-[1-[4-[(4-fluorophenyl)methyl]-1-piperidyl]ethylsulfanyl]-2-nitro-phenol CAS Name: 3-[1-[4-[(4-fluorophenyl)methyl]-1-piperidinyl]ethylthio]-2-nitrophenol IUPAC Name: 3-[1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]ethylsulfanyl]-2-nitrophenol Traditional Name: 3-[1-[4-(4-fluorobenzyl)piperidino]ethylthio]-2-nitro-phenol Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCC(CC1)CC2=CC=C(C=C2)F)SC3=CC=CC(=C3[N+](=O)[O-])O

Isomeric SMILES

CC(N1CCC(CC1)CC2=CC=C(C=C2)F)SC3=CC=CC(=C3[N+](=O)[O-])O

InChI

InChI=1S/C20H23FN2O3S/c1-14(27-19-4-2-3-18(24)20(19)23(25)26)22-11-9-16(10-12-22)13-15-5-7-17(21)8-6-15/h2-8,14,16,24H,9-13H2,1H3