1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]piperidin-1-yl]-2-(2-fluorophenyl)ethanone

Systemtic Name: 1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]piperidin-1-yl]-2-(2-fluorophenyl)ethanone Openeye Name: 1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]-1-piperidyl]-2-(2-fluorophenyl)ethanone CAS Name: 1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]-1-piperidinyl]-2-(2-fluorophenyl)ethanone IUPAC Name: 1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]piperidin-1-yl]-2-(2-fluorophenyl)ethanone Traditional Name: 1-cyclopropyl-2-[4-[(2,4-dinitrophenyl)disulfanyl]piperidino]-2-(2-fluorophenyl)ethanone Formula: C22H22FN3O5S2 MolecularWeight: 491.555583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(CC3)SSC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(CC3)SSC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H22FN3O5S2/c23-18-4-2-1-3-17(18)21(22(27)14-5-6-14)24-11-9-16(10-12-24)32-33-20-8-7-15(25(28)29)13-19(20)26(30)31/h1-4,7-8,13-14,16,21H,5-6,9-12H2