1-[(4-chloranyl-2-cyano-phenyl)methyl]indazole-3-carboxylic acid

Systemtic Name: 1-[(4-chloranyl-2-cyano-phenyl)methyl]indazole-3-carboxylic acid Openeye Name: 1-[(4-chloro-2-cyano-phenyl)methyl]indazole-3-carboxylic acid CAS Name: 1-[(4-chloro-2-cyanophenyl)methyl]-3-indazolecarboxylic acid IUPAC Name: 1-[(4-chloro-2-cyanophenyl)methyl]indazole-3-carboxylic acid Traditional Name: 1-(4-chloro-2-cyano-benzyl)indazole-3-carboxylic acid Formula: C16H10ClN3O2 MolecularWeight: 311.7225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2CC3=C(C=C(C=C3)Cl)C#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2CC3=C(C=C(C=C3)Cl)C#N)C(=O)O

InChI

InChI=1S/C16H10ClN3O2/c17-12-6-5-10(11(7-12)8-18)9-20-14-4-2-1-3-13(14)15(19-20)16(21)22/h1-7H,9H2,(H,21,22)