(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 1-ethylbenzotriazole-5-carboxylate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC(C)C(=O)N3CCCC3)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC(C)C(=O)N3CCCC3)N=N1

InChI

InChI=1S/C16H20N4O3/c1-3-20-14-7-6-12(10-13(14)17-18-20)16(22)23-11(2)15(21)19-8-4-5-9-19/h6-7,10-11H,3-5,8-9H2,1-2H3