diethyl 1-[1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-[1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-[1-[(2-methoxy-5-methyl-phenyl)carbamoyl]propyl]triazole-4,5-dicarboxylate CAS Name: 1-[1-(2-methoxy-5-methylanilino)-1-oxobutan-2-yl]triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[1-(2-methoxy-5-methylanilino)-1-oxobutan-2-yl]triazole-4,5-dicarboxylate Traditional Name: 1-[1-[(2-methoxy-5-methyl-phenyl)carbamoyl]propyl]triazole-4,5-dicarboxylic acid diethyl ester Formula: C20H26N4O6 MolecularWeight: 418.44364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C)OC)N2C(=C(N=N2)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C)OC)N2C(=C(N=N2)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H26N4O6/c1-6-14(18(25)21-13-11-12(4)9-10-15(13)28-5)24-17(20(27)30-8-3)16(22-23-24)19(26)29-7-2/h9-11,14H,6-8H2,1-5H3,(H,21,25)