1-(4-butan-2-ylphenyl)sulfonyl-2,3-dihydroindole-5-carboxylic acid

Systemtic Name: 1-(4-butan-2-ylphenyl)sulfonyl-2,3-dihydroindole-5-carboxylic acid Openeye Name: 1-(4-sec-butylphenyl)sulfonylindoline-5-carboxylic acid CAS Name: 1-(4-butan-2-ylphenyl)sulfonyl-2,3-dihydroindole-5-carboxylic acid IUPAC Name: 1-(4-butan-2-ylphenyl)sulfonyl-2,3-dihydroindole-5-carboxylic acid Traditional Name: 1-(4-sec-butylphenyl)sulfonylindoline-5-carboxylic acid Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=C2C=CC(=C3)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=C2C=CC(=C3)C(=O)O

InChI

InChI=1S/C19H21NO4S/c1-3-13(2)14-4-7-17(8-5-14)25(23,24)20-11-10-15-12-16(19(21)22)6-9-18(15)20/h4-9,12-13H,3,10-11H2,1-2H3,(H,21,22)