7-tert-butylsulfinyl-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid

Systemtic Name: 7-tert-butylsulfinyl-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Openeye Name: 9-benzoyl-7-tert-butylsulfinyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid CAS Name: 9-benzoyl-7-tert-butylsulfinyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid IUPAC Name: 9-benzoyl-7-tert-butylsulfinyl-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid Traditional Name: 9-benzoyl-7-tert-butylsulfinyl-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=CC2=C(C=C1)C3=C(N2C(=O)C4=CC=CC=C4)CCC(C3)C(=O)O

Isomeric SMILES

CC(C)(C)S(=O)C1=CC2=C(C=C1)C3=C(N2C(=O)C4=CC=CC=C4)CCC(C3)C(=O)O

InChI

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