1-[3-(4-chlorophenyl)-6-methoxy-2,1-benzoxazol-5-yl]-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[3-(4-chlorophenyl)-6-methoxy-2,1-benzoxazol-5-yl]-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[3-(4-chlorophenyl)-6-methoxy-2,1-benzoxazol-5-yl]-5-cyclopropyl-triazole-4-carboxylic acid CAS Name: 1-[3-(4-chlorophenyl)-6-methoxy-2,1-benzoxazol-5-yl]-5-cyclopropyl-4-triazolecarboxylic acid IUPAC Name: 1-[3-(4-chlorophenyl)-6-methoxy-2,1-benzoxazol-5-yl]-5-cyclopropyltriazole-4-carboxylic acid Traditional Name: 1-[3-(4-chlorophenyl)-6-methoxy-anthranil-5-yl]-5-cyclopropyl-triazole-4-carboxylic acid Formula: C20H15ClN4O4 MolecularWeight: 410.8105

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NOC(=C2C=C1N3C(=C(N=N3)C(=O)O)C4CC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC2=NOC(=C2C=C1N3C(=C(N=N3)C(=O)O)C4CC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H15ClN4O4/c1-28-16-9-14-13(19(29-23-14)11-4-6-12(21)7-5-11)8-15(16)25-18(10-2-3-10)17(20(26)27)22-24-25/h4-10H,2-3H2,1H3,(H,26,27)