1-(3-chloranyl-4-methoxy-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methoxy-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(3-chloro-4-methoxyphenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(3-chloro-4-methoxyphenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methoxy-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Formula: C13H12ClN3O3 MolecularWeight: 293.70568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C3CC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=NC(=N2)C(=O)O)C3CC3)Cl

InChI

InChI=1S/C13H12ClN3O3/c1-20-10-5-4-8(6-9(10)14)17-12(7-2-3-7)15-11(16-17)13(18)19/h4-7H,2-3H2,1H3,(H,18,19)