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

Systemtic Name: 1-[3-(4-chlorophenyl)-6-methyl-2,1-benzoxazol-5-yl]-5-methyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[3-(4-chlorophenyl)-6-methyl-2,1-benzoxazol-5-yl]-5-methyl-triazole-4-carboxylic acid CAS Name: 1-[3-(4-chlorophenyl)-6-methyl-2,1-benzoxazol-5-yl]-5-methyl-4-triazolecarboxylic acid IUPAC Name: 1-[3-(4-chlorophenyl)-6-methyl-2,1-benzoxazol-5-yl]-5-methyltriazole-4-carboxylic acid Traditional Name: 1-[3-(4-chlorophenyl)-6-methyl-anthranil-5-yl]-5-methyl-triazole-4-carboxylic acid Formula: C18H13ClN4O3 MolecularWeight: 368.77382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NOC(=C2C=C1N3C(=C(N=N3)C(=O)O)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=NOC(=C2C=C1N3C(=C(N=N3)C(=O)O)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN4O3/c1-9-7-14-13(17(26-21-14)11-3-5-12(19)6-4-11)8-15(9)23-10(2)16(18(24)25)20-22-23/h3-8H,1-2H3,(H,24,25)