dimethyl 1-[2-[(3-ethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-[(3-ethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-[2-[(3-ethylphenyl)carbamoylamino]-2-oxo-ethyl]triazole-4,5-dicarboxylate CAS Name: 1-[2-[[(3-ethylanilino)-oxomethyl]amino]-2-oxoethyl]triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-[(3-ethylphenyl)carbamoylamino]-2-oxoethyl]triazole-4,5-dicarboxylate Traditional Name: 1-[2-[(3-ethylphenyl)carbamoylamino]-2-keto-ethyl]triazole-4,5-dicarboxylic acid dimethyl ester Formula: C17H19N5O6 MolecularWeight: 389.36266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H19N5O6/c1-4-10-6-5-7-11(8-10)18-17(26)19-12(23)9-22-14(16(25)28-3)13(20-21-22)15(24)27-2/h5-8H,4,9H2,1-3H3,(H2,18,19,23,26)