methyl 3,4,5-trimethoxy-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 3,4,5-trimethoxy-2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 3,4,5-trimethoxy-2-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]benzoate CAS Name: 3,4,5-trimethoxy-2-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3,4,5-trimethoxy-2-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]benzoate Traditional Name: 3,4,5-trimethoxy-2-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=C(C(=C(C=C2C(=O)OC)OC)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=C(C(=C(C=C2C(=O)OC)OC)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O6/c1-12-16(24-25(23-12)13-9-7-6-8-10-13)20(26)22-17-14(21(27)31-5)11-15(28-2)18(29-3)19(17)30-4/h6-11H,1-5H3,(H,22,26)