3-[[1-[(4-tert-butylphenyl)methyl]indol-5-yl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[1-[(4-tert-butylphenyl)methyl]indol-5-yl]sulfamoyl]benzoic acid Openeye Name: 3-[[1-[(4-tert-butylphenyl)methyl]indol-5-yl]sulfamoyl]benzoic acid CAS Name: 3-[[1-[(4-tert-butylphenyl)methyl]-5-indolyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[1-[(4-tert-butylphenyl)methyl]indol-5-yl]sulfamoyl]benzoic acid Traditional Name: 3-[[1-(4-tert-butylbenzyl)indol-5-yl]sulfamoyl]benzoic acid Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=CC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=CC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C26H26N2O4S/c1-26(2,3)21-9-7-18(8-10-21)17-28-14-13-19-15-22(11-12-24(19)28)27-33(31,32)23-6-4-5-20(16-23)25(29)30/h4-16,27H,17H2,1-3H3,(H,29,30)