N-[4-[2-(4-acetamidophenyl)-5-(hydroxyiminomethyl)-4-nitro-furan-3-yl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(4-acetamidophenyl)-5-(hydroxyiminomethyl)-4-nitro-furan-3-yl]phenyl]ethanamide Openeye Name: N-[4-[2-(4-acetamidophenyl)-5-(hydroxyiminomethyl)-4-nitro-3-furyl]phenyl]acetamide CAS Name: N-[4-[2-(4-acetamidophenyl)-5-(hydroxyiminomethyl)-4-nitro-3-furanyl]phenyl]acetamide IUPAC Name: N-[4-[2-(4-acetamidophenyl)-5-(hydroxyiminomethyl)-4-nitrofuran-3-yl]phenyl]acetamide Traditional Name: N-[4-[2-(4-acetamidophenyl)-5-(hydroximinomethyl)-4-nitro-3-furyl]phenyl]acetamide Formula: C21H18N4O6 MolecularWeight: 422.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=C(OC(=C2[N+](=O)[O-])C=NO)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=C(OC(=C2[N+](=O)[O-])C=NO)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H18N4O6/c1-12(26)23-16-7-3-14(4-8-16)19-20(25(29)30)18(11-22-28)31-21(19)15-5-9-17(10-6-15)24-13(2)27/h3-11,28H,1-2H3,(H,23,26)(H,24,27)