methyl 3-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-(4-butylanilino)-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-(4-butylanilino)-2-oxoethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(4-butylanilino)-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-(4-butylanilino)-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2

InChI

InChI=1S/C20H22N4O4/c1-3-4-5-14-6-9-16(10-7-14)21-19(25)13-28-24-18-12-15(20(26)27-2)8-11-17(18)22-23-24/h6-12H,3-5,13H2,1-2H3,(H,21,25)