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

Systemtic Name: methyl 4-chloranyl-3-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[(2-phenyltriazole-4-carbonyl)amino]benzoate CAS Name: 4-chloro-3-[[oxo-(2-phenyl-4-triazolyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(2-phenyltriazole-4-carbonyl)amino]benzoate Traditional Name: 4-chloro-3-[(2-phenyltriazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C17H13ClN4O3 MolecularWeight: 356.76312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H13ClN4O3/c1-25-17(24)11-7-8-13(18)14(9-11)20-16(23)15-10-19-22(21-15)12-5-3-2-4-6-12/h2-10H,1H3,(H,20,23)