8-(4-methylsulfonyl-2-nitro-phenyl)-2,4,8-triazaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-(4-methylsulfonyl-2-nitro-phenyl)-2,4,8-triazaspiro[4.5]decane-1,3-dione Openeye Name: 8-(4-methylsulfonyl-2-nitro-phenyl)-2,4,8-triazaspiro[4.5]decane-1,3-dione CAS Name: 8-(4-methylsulfonyl-2-nitrophenyl)-2,4,8-triazaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(4-methylsulfonyl-2-nitrophenyl)-2,4,8-triazaspiro[4.5]decane-1,3-dione Traditional Name: 8-(4-mesyl-2-nitro-phenyl)-2,4,8-triazaspiro[4.5]decane-1,3-quinone Formula: C14H16N4O6S MolecularWeight: 368.36504

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCC3(CC2)C(=O)NC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCC3(CC2)C(=O)NC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O6S/c1-25(23,24)9-2-3-10(11(8-9)18(21)22)17-6-4-14(5-7-17)12(19)15-13(20)16-14/h2-3,8H,4-7H2,1H3,(H2,15,16,19,20)