2-[3,5-bis(chloranyl)phenyl]sulfonyl-1-methyl-3H-isoindole-1-carboxylic acid

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]sulfonyl-1-methyl-3H-isoindole-1-carboxylic acid Openeye Name: 2-(3,5-dichlorophenyl)sulfonyl-1-methyl-isoindoline-1-carboxylic acid CAS Name: 2-(3,5-dichlorophenyl)sulfonyl-1-methyl-3H-isoindole-1-carboxylic acid IUPAC Name: 2-(3,5-dichlorophenyl)sulfonyl-1-methyl-3H-isoindole-1-carboxylic acid Traditional Name: 2-(3,5-dichlorophenyl)sulfonyl-1-methyl-isoindoline-1-carboxylic acid Formula: C16H13Cl2NO4S MolecularWeight: 386.24972

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2CN1S(=O)(=O)C3=CC(=CC(=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CC1(C2=CC=CC=C2CN1S(=O)(=O)C3=CC(=CC(=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C16H13Cl2NO4S/c1-16(15(20)21)14-5-3-2-4-10(14)9-19(16)24(22,23)13-7-11(17)6-12(18)8-13/h2-8H,9H2,1H3,(H,20,21)