ethyl 5-(2-azanyl-4,5-dimethoxy-phenyl)carbonyl-2-(ethoxymethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(2-azanyl-4,5-dimethoxy-phenyl)carbonyl-2-(ethoxymethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(2-amino-4,5-dimethoxy-benzoyl)-2-(ethoxymethyl)triazole-4-carboxylate CAS Name: 5-[(2-amino-4,5-dimethoxyphenyl)-oxomethyl]-2-(ethoxymethyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-4,5-dimethoxybenzoyl)-2-(ethoxymethyl)triazole-4-carboxylate Traditional Name: 5-(2-amino-4,5-dimethoxy-benzoyl)-2-(ethoxymethyl)triazole-4-carboxylic acid ethyl ester Formula: C17H22N4O6 MolecularWeight: 378.37978

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1N=C(C(=N1)C(=O)OCC)C(=O)C2=CC(=C(C=C2N)OC)OC

Isomeric SMILES

CCOCN1N=C(C(=N1)C(=O)OCC)C(=O)C2=CC(=C(C=C2N)OC)OC

InChI

InChI=1S/C17H22N4O6/c1-5-26-9-21-19-14(15(20-21)17(23)27-6-2)16(22)10-7-12(24-3)13(25-4)8-11(10)18/h7-8H,5-6,9,18H2,1-4H3