methyl 1-(5-oxidanylidene-3-phenyl-1H-1,2,4-triazol-4-yl)aziridine-2-carboxylate

Systemtic Name: methyl 1-(5-oxidanylidene-3-phenyl-1H-1,2,4-triazol-4-yl)aziridine-2-carboxylate Openeye Name: methyl 1-(5-oxo-3-phenyl-1H-1,2,4-triazol-4-yl)aziridine-2-carboxylate CAS Name: 1-(5-oxo-3-phenyl-1H-1,2,4-triazol-4-yl)-2-aziridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-oxo-3-phenyl-1H-1,2,4-triazol-4-yl)aziridine-2-carboxylate Traditional Name: 1-(5-keto-3-phenyl-1H-1,2,4-triazol-4-yl)ethylenimine-2-carboxylic acid methyl ester Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN1N2C(=NNC2=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CN1N2C(=NNC2=O)C3=CC=CC=C3

InChI

InChI=1S/C12H12N4O3/c1-19-11(17)9-7-15(9)16-10(13-14-12(16)18)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,14,18)