1-(4-fluoranyl-3-methyl-phenyl)sulfonyl-8-(2-methyl-5-nitro-phenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane

Systemtic Name: 1-(4-fluoranyl-3-methyl-phenyl)sulfonyl-8-(2-methyl-5-nitro-phenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane Openeye Name: 1-(4-fluoro-3-methyl-phenyl)sulfonyl-8-(2-methyl-5-nitro-phenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane CAS Name: 1-(4-fluoro-3-methylphenyl)sulfonyl-8-(2-methyl-5-nitrophenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane IUPAC Name: 1-(4-fluoro-3-methylphenyl)sulfonyl-8-(2-methyl-5-nitrophenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane Traditional Name: 1-(4-fluoro-3-methyl-phenyl)sulfonyl-8-(2-methyl-5-nitro-phenyl)sulfonyl-4-oxa-1,8-diazaspiro[4.5]decane Formula: C21H24FN3O7S2 MolecularWeight: 513.559563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC3(CC2)N(CCO3)S(=O)(=O)C4=CC(=C(C=C4)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC3(CC2)N(CCO3)S(=O)(=O)C4=CC(=C(C=C4)F)C

InChI

InChI=1S/C21H24FN3O7S2/c1-15-3-4-17(25(26)27)14-20(15)34(30,31)23-9-7-21(8-10-23)24(11-12-32-21)33(28,29)18-5-6-19(22)16(2)13-18/h3-6,13-14H,7-12H2,1-2H3