1-[[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methyl]-5-nitro-indazole

Systemtic Name: 1-[[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]methyl]-5-nitro-indazole Openeye Name: 1-[[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]methyl]-5-nitro-indazole CAS Name: 1-[[4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]methyl]-5-nitroindazole IUPAC Name: 1-[[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]methyl]-5-nitroindazole Traditional Name: 1-[[4-(3,4-difluorophenyl)sulfonylpiperazino]methyl]-5-nitro-indazole Formula: C18H17F2N5O4S MolecularWeight: 437.420486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)S(=O)(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)S(=O)(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C18H17F2N5O4S/c19-16-3-2-15(10-17(16)20)30(28,29)23-7-5-22(6-8-23)12-24-18-4-1-14(25(26)27)9-13(18)11-21-24/h1-4,9-11H,5-8,12H2