1-[(3,4-dichlorophenyl)methyl]-3-(methylsulfonylamino)indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-3-(methylsulfonylamino)indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-3-(methanesulfonamido)indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-3-(methanesulfonamido)-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-3-(methanesulfonamido)indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-3-(methanesulfonamido)indole-2-carboxylic acid Formula: C17H14Cl2N2O4S MolecularWeight: 413.27506

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(N(C2=CC=CC=C21)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=C(N(C2=CC=CC=C21)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H14Cl2N2O4S/c1-26(24,25)20-15-11-4-2-3-5-14(11)21(16(15)17(22)23)9-10-6-7-12(18)13(19)8-10/h2-8,20H,9H2,1H3,(H,22,23)