4-(2-methylpropylsulfonyl)-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid

Systemtic Name: 4-(2-methylpropylsulfonyl)-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Openeye Name: 9-benzoyl-4-isobutylsulfonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid CAS Name: 9-benzoyl-4-(2-methylpropylsulfonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid IUPAC Name: 9-benzoyl-4-(2-methylpropylsulfonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Traditional Name: 9-benzoyl-4-isobutylsulfonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1C(CCC2=C1C3=CC=CC=C3N2C(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)CS(=O)(=O)C1C(CCC2=C1C3=CC=CC=C3N2C(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H25NO5S/c1-15(2)14-31(29,30)22-18(24(27)28)12-13-20-21(22)17-10-6-7-11-19(17)25(20)23(26)16-8-4-3-5-9-16/h3-11,15,18,22H,12-14H2,1-2H3,(H,27,28)