[2-[2-(4-nitrophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-(propan-2-yloxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[2-(4-nitrophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-(propan-2-yloxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-[2-(4-nitrobenzoyl)hydrazino]-2-oxo-ethyl] 3-(isopropoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(propan-2-yloxymethyl)-2-benzofurancarboxylic acid [2-[[(4-nitrophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl] 3-(propan-2-yloxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(isopropoxymethyl)coumarilic acid [2-keto-2-[N'-(4-nitrobenzoyl)hydrazino]ethyl] ester Formula: C22H21N3O8 MolecularWeight: 455.41744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O8/c1-13(2)31-11-17-16-5-3-4-6-18(16)33-20(17)22(28)32-12-19(26)23-24-21(27)14-7-9-15(10-8-14)25(29)30/h3-10,13H,11-12H2,1-2H3,(H,23,26)(H,24,27)