ethyl 4-(1-ethylbenzotriazol-5-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(1-ethylbenzotriazol-5-yl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(1-ethylbenzotriazole-5-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1-ethyl-5-benzotriazolyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-ethylbenzotriazole-5-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-ethylbenzotriazole-5-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)OCC)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)OCC)N=N1

InChI

InChI=1S/C16H21N5O3/c1-3-21-14-6-5-12(11-13(14)17-18-21)15(22)19-7-9-20(10-8-19)16(23)24-4-2/h5-6,11H,3-4,7-10H2,1-2H3