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

Systemtic Name: ethyl 5-(2-azanyl-4,5-dimethoxy-phenyl)carbonyl-2-(2-dimethylaminoethylcarbamoyloxymethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(2-amino-4,5-dimethoxy-benzoyl)-2-(2-dimethylaminoethylcarbamoyloxymethyl)triazole-4-carboxylate CAS Name: 5-[(2-amino-4,5-dimethoxyphenyl)-oxomethyl]-2-[[(2-dimethylaminoethylamino)-oxomethoxy]methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-4,5-dimethoxybenzoyl)-2-(2-dimethylaminoethylcarbamoyloxymethyl)triazole-4-carboxylate Traditional Name: 5-(2-amino-4,5-dimethoxy-benzoyl)-2-(2-dimethylaminoethylcarbamoyloxymethyl)triazole-4-carboxylic acid ethyl ester Formula: C20H28N6O7 MolecularWeight: 464.47232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(N=C1C(=O)C2=CC(=C(C=C2N)OC)OC)COC(=O)NCCN(C)C

Isomeric SMILES

CCOC(=O)C1=NN(N=C1C(=O)C2=CC(=C(C=C2N)OC)OC)COC(=O)NCCN(C)C

InChI

InChI=1S/C20H28N6O7/c1-6-32-19(28)17-16(18(27)12-9-14(30-4)15(31-5)10-13(12)21)23-26(24-17)11-33-20(29)22-7-8-25(2)3/h9-10H,6-8,11,21H2,1-5H3,(H,22,29)