2-[5-cyano-1-(phenylsulfonyl)indazol-3-yl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-[5-cyano-1-(phenylsulfonyl)indazol-3-yl]cyclopropane-1-carboxylic acid Openeye Name: 2-[1-(benzenesulfonyl)-5-cyano-indazol-3-yl]cyclopropanecarboxylic acid CAS Name: 2-[1-(benzenesulfonyl)-5-cyano-3-indazolyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[1-(benzenesulfonyl)-5-cyanoindazol-3-yl]cyclopropane-1-carboxylic acid Traditional Name: 2-(1-besyl-5-cyano-indazol-3-yl)cyclopropanecarboxylic acid Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)O)C2=NN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C1C(=O)O)C2=NN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H13N3O4S/c19-10-11-6-7-16-15(8-11)17(13-9-14(13)18(22)23)20-21(16)26(24,25)12-4-2-1-3-5-12/h1-8,13-14H,9H2,(H,22,23)