3-[2-[(4-pentylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(4-pentylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-[(4-pentylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-[(4-pentylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-[(4-pentylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-[(4-amylphenyl)sulfonylamino]ethyl]-1H-indole-2-carboxylic acid Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCCC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NCCC2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H26N2O4S/c1-2-3-4-7-16-10-12-17(13-11-16)29(27,28)23-15-14-19-18-8-5-6-9-20(18)24-21(19)22(25)26/h5-6,8-13,23-24H,2-4,7,14-15H2,1H3,(H,25,26)