5-chloranyl-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-1H-indole-2-carboxylic acid Formula: C17H14ClNO4S MolecularWeight: 363.81536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)C

InChI

InChI=1S/C17H14ClNO4S/c1-9-5-10(2)7-12(6-9)24(22,23)16-13-8-11(18)3-4-14(13)19-15(16)17(20)21/h3-8,19H,1-2H3,(H,20,21)