4-(2-azanyl-4,5-dimethyl-phenyl)carbonyl-3-[(4-methoxyphenyl)methyl]-2H-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 4-(2-azanyl-4,5-dimethyl-phenyl)carbonyl-3-[(4-methoxyphenyl)methyl]-2H-1,2,3-triazole-4-carboxylic acid Openeye Name: 4-(2-amino-4,5-dimethyl-benzoyl)-3-[(4-methoxyphenyl)methyl]-2H-triazole-4-carboxylic acid CAS Name: 4-[(2-amino-4,5-dimethylphenyl)-oxomethyl]-3-[(4-methoxyphenyl)methyl]-2H-triazole-4-carboxylic acid IUPAC Name: 4-(2-amino-4,5-dimethylbenzoyl)-3-[(4-methoxyphenyl)methyl]-2H-triazole-4-carboxylic acid Traditional Name: 4-(2-amino-4,5-dimethyl-benzoyl)-3-p-anisyl-2H-triazole-4-carboxylic acid Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=O)C2(C=NNN2CC3=CC=C(C=C3)OC)C(=O)O)N)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C(=O)C2(C=NNN2CC3=CC=C(C=C3)OC)C(=O)O)N)C

InChI

InChI=1S/C20H22N4O4/c1-12-8-16(17(21)9-13(12)2)18(25)20(19(26)27)11-22-23-24(20)10-14-4-6-15(28-3)7-5-14/h4-9,11,23H,10,21H2,1-3H3,(H,26,27)