3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(5-nitro-2-oxidanyl-phenyl)methyl]propanamide

Systemtic Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(5-nitro-2-oxidanyl-phenyl)methyl]propanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H18N4O6/c1-28-15-5-2-12(3-6-15)19-21-18(29-22-19)9-8-17(25)20-11-13-10-14(23(26)27)4-7-16(13)24/h2-7,10,24H,8-9,11H2,1H3,(H,20,25)