[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (3-o-phenetyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=CN3C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O6/c1-3-25-14-7-5-4-6-12(14)16-18-15(27-19-16)10-26-17(22)13-8-11(21(23)24)9-20(13)2/h4-9H,3,10H2,1-2H3