[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C23H20N6O3 MolecularWeight: 428.4433

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)N=N1

InChI

InChI=1S/C23H20N6O3/c1-2-29-21-13-8-16(14-20(21)27-28-29)23(31)32-15-22(30)24-17-9-11-19(12-10-17)26-25-18-6-4-3-5-7-18/h3-14H,2,15H2,1H3,(H,24,30)