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

Systemtic Name: 5-methyl-1-(6-methyl-3-phenyl-2,1-benzoxazol-5-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-methyl-1-(6-methyl-3-phenyl-2,1-benzoxazol-5-yl)triazole-4-carboxylic acid CAS Name: 5-methyl-1-(6-methyl-3-phenyl-2,1-benzoxazol-5-yl)-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-(6-methyl-3-phenyl-2,1-benzoxazol-5-yl)triazole-4-carboxylic acid Traditional Name: 5-methyl-1-(6-methyl-3-phenyl-anthranil-5-yl)triazole-4-carboxylic acid Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O3/c1-10-8-14-13(17(25-20-14)12-6-4-3-5-7-12)9-15(10)22-11(2)16(18(23)24)19-21-22/h3-9H,1-2H3,(H,23,24)