ethyl 3-[(4-methoxyphenyl)methyl]-5-[(2-nitrophenyl)-oxidanyl-methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 3-[(4-methoxyphenyl)methyl]-5-[(2-nitrophenyl)-oxidanyl-methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-[hydroxy-(2-nitrophenyl)methyl]-3-[(4-methoxyphenyl)methyl]triazole-4-carboxylate CAS Name: 5-[hydroxy-(2-nitrophenyl)methyl]-3-[(4-methoxyphenyl)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[hydroxy-(2-nitrophenyl)methyl]-3-[(4-methoxyphenyl)methyl]triazole-4-carboxylate Traditional Name: 5-[hydroxy-(2-nitrophenyl)methyl]-3-p-anisyl-triazole-4-carboxylic acid ethyl ester Formula: C20H20N4O6 MolecularWeight: 412.396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=NN1CC2=CC=C(C=C2)OC)C(C3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=C(N=NN1CC2=CC=C(C=C2)OC)C(C3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C20H20N4O6/c1-3-30-20(26)18-17(19(25)15-6-4-5-7-16(15)24(27)28)21-22-23(18)12-13-8-10-14(29-2)11-9-13/h4-11,19,25H,3,12H2,1-2H3