methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-(homoveratrylamino)-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C20H22N4O6 MolecularWeight: 414.41188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O6/c1-27-17-7-4-13(10-18(17)28-2)8-9-21-19(25)12-30-24-16-11-14(20(26)29-3)5-6-15(16)22-23-24/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,25)