[2-[4-[2-(1-ethylbenzotriazol-5-yl)carbonyloxyethanoyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-[4-[2-(1-ethylbenzotriazol-5-yl)carbonyloxyethanoyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-[4-[2-(1-ethylbenzotriazole-5-carbonyl)oxyacetyl]piperazin-1-yl]-2-oxo-ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-[4-[2-[(1-ethyl-5-benzotriazolyl)-oxomethoxy]-1-oxoethyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[2-(1-ethylbenzotriazole-5-carbonyl)oxyacetyl]piperazin-1-yl]-2-oxoethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-[4-[2-(1-ethylbenzotriazole-5-carbonyl)oxyacetyl]piperazino]-2-keto-ethyl] ester Formula: C26H28N8O6 MolecularWeight: 548.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)N3CCN(CC3)C(=O)COC(=O)C4=CC5=C(C=C4)N(N=N5)CC)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)N3CCN(CC3)C(=O)COC(=O)C4=CC5=C(C=C4)N(N=N5)CC)N=N1

InChI

InChI=1S/C26H28N8O6/c1-3-33-21-7-5-17(13-19(21)27-29-33)25(37)39-15-23(35)31-9-11-32(12-10-31)24(36)16-40-26(38)18-6-8-22-20(14-18)28-30-34(22)4-2/h5-8,13-14H,3-4,9-12,15-16H2,1-2H3