ethyl 2-[3-[[(4-diazanyl-4-oxidanylidene-butanoyl)-ethyl-amino]methyl]-5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]benzotriazole-5-carboxylate

Systemtic Name: ethyl 2-[3-[[(4-diazanyl-4-oxidanylidene-butanoyl)-ethyl-amino]methyl]-5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]benzotriazole-5-carboxylate Openeye Name: ethyl 2-[5-(1,1-dimethylpropyl)-3-[[ethyl-(4-hydrazino-4-oxo-butanoyl)amino]methyl]-2-hydroxy-phenyl]benzotriazole-5-carboxylate CAS Name: 2-[3-[[ethyl-(4-hydrazinyl-1,4-dioxobutyl)amino]methyl]-2-hydroxy-5-(2-methylbutan-2-yl)phenyl]-5-benzotriazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-[[ethyl-(4-hydrazinyl-4-oxobutanoyl)amino]methyl]-2-hydroxy-5-(2-methylbutan-2-yl)phenyl]benzotriazole-5-carboxylate Traditional Name: 2-[5-tert-amyl-3-[[ethyl-(4-hydrazino-4-keto-butanoyl)amino]methyl]-2-hydroxy-phenyl]benzotriazole-5-carboxylic acid ethyl ester Formula: C27H36N6O5 MolecularWeight: 524.61194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)C(=O)OCC)O)CN(CC)C(=O)CCC(=O)NN

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)C(=O)OCC)O)CN(CC)C(=O)CCC(=O)NN

InChI

InChI=1S/C27H36N6O5/c1-6-27(4,5)19-13-18(16-32(7-2)24(35)12-11-23(34)29-28)25(36)22(15-19)33-30-20-10-9-17(14-21(20)31-33)26(37)38-8-3/h9-10,13-15,36H,6-8,11-12,16,28H2,1-5H3,(H,29,34)