[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC(=O)NCC=C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC(=O)NCC=C)N=N1

InChI

InChI=1S/C15H17N5O4/c1-3-7-16-15(23)17-13(21)9-24-14(22)10-5-6-12-11(8-10)18-19-20(12)4-2/h3,5-6,8H,1,4,7,9H2,2H3,(H2,16,17,21,23)