4-[[1-(phenylsulfonyl)-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[1-(phenylsulfonyl)-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid Openeye Name: 4-[[1-(benzenesulfonyl)indoline-6-carbonyl]amino]benzoic acid CAS Name: 4-[[[1-(benzenesulfonyl)-2,3-dihydroindol-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[1-(benzenesulfonyl)-2,3-dihydroindole-6-carbonyl]amino]benzoic acid Traditional Name: 4-[(1-besylindoline-6-carbonyl)amino]benzoic acid Formula: C22H18N2O5S MolecularWeight: 422.45372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O5S/c25-21(23-18-10-8-16(9-11-18)22(26)27)17-7-6-15-12-13-24(20(15)14-17)30(28,29)19-4-2-1-3-5-19/h1-11,14H,12-13H2,(H,23,25)(H,26,27)