3-cyclohexyl-2-phenyl-1-(phenylsulfonyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-phenyl-1-(phenylsulfonyl)indole-6-carboxylic acid Openeye Name: 1-(benzenesulfonyl)-3-cyclohexyl-2-phenyl-indole-6-carboxylic acid CAS Name: 1-(benzenesulfonyl)-3-cyclohexyl-2-phenyl-6-indolecarboxylic acid IUPAC Name: 1-(benzenesulfonyl)-3-cyclohexyl-2-phenylindole-6-carboxylic acid Traditional Name: 1-besyl-3-cyclohexyl-2-phenyl-indole-6-carboxylic acid Formula: C27H25NO4S MolecularWeight: 459.5567

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25NO4S/c29-27(30)21-16-17-23-24(18-21)28(33(31,32)22-14-8-3-9-15-22)26(20-12-6-2-7-13-20)25(23)19-10-4-1-5-11-19/h2-3,6-9,12-19H,1,4-5,10-11H2,(H,29,30)