methyl 1-[2-[(3-nitrophenyl)carbonylamino]phenyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-nitrophenyl)carbonylamino]phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[2-[(3-nitrobenzoyl)amino]phenyl]triazole-4-carboxylate CAS Name: 1-[2-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(3-nitrobenzoyl)amino]phenyl]triazole-4-carboxylate Traditional Name: 1-[2-[(3-nitrobenzoyl)amino]phenyl]triazole-4-carboxylic acid methyl ester Formula: C17H13N5O5 MolecularWeight: 367.31562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CN(N=N1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O5/c1-27-17(24)14-10-21(20-19-14)15-8-3-2-7-13(15)18-16(23)11-5-4-6-12(9-11)22(25)26/h2-10H,1H3,(H,18,23)