9-(3-tert-butylsulfinylphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid

Systemtic Name: 9-(3-tert-butylsulfinylphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Openeye Name: 9-(3-tert-butylsulfinylbenzoyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid CAS Name: 9-[(3-tert-butylsulfinylphenyl)-oxomethyl]-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid IUPAC Name: 9-(3-tert-butylsulfinylbenzoyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Traditional Name: 9-(3-tert-butylsulfinylbenzoyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Formula: C24H25NO4S MolecularWeight: 423.5246

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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)C4=CC=CC=C42

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO4S/c1-24(2,3)30(29)17-8-6-7-15(13-17)22(26)25-20-10-5-4-9-18(20)19-14-16(23(27)28)11-12-21(19)25/h4-10,13,16H,11-12,14H2,1-3H3,(H,27,28)