9-(3-tert-butylsulfinylphenyl)carbonyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid

Systemtic Name: 9-(3-tert-butylsulfinylphenyl)carbonyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Openeye Name: 9-(3-tert-butylsulfinylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid CAS Name: 9-[(3-tert-butylsulfinylphenyl)-oxomethyl]-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid IUPAC Name: 9-(3-tert-butylsulfinylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Traditional Name: 9-(3-tert-butylsulfinylbenzoyl)-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)C1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=CC=CC=C42

Isomeric SMILES

CC(C)(C)S(=O)C1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=CC=CC=C42

InChI

InChI=1S/C25H25NO6S/c1-24(2,3)33(32)16-8-6-7-15(13-16)21(27)26-19-10-5-4-9-17(19)18-14-25(22(28)29,23(30)31)12-11-20(18)26/h4-10,13H,11-12,14H2,1-3H3,(H,28,29)(H,30,31)