methyl 3-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C17H15ClN4O5 MolecularWeight: 390.7778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2

InChI

InChI=1S/C17H15ClN4O5/c1-25-15-6-4-11(18)8-13(15)19-16(23)9-27-22-14-7-10(17(24)26-2)3-5-12(14)20-21-22/h3-8H,9H2,1-2H3,(H,19,23)