3-(3-methoxyphenyl)-N-[3-nitro-5-(4-oxidanylphenoxy)phenyl]-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-[3-nitro-5-(4-oxidanylphenoxy)phenyl]-1,2-oxazole-5-carboxamide Openeye Name: N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]-3-(3-methoxyphenyl)isoxazole-5-carboxamide CAS Name: N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]-3-(3-methoxyphenyl)-5-isoxazolecarboxamide IUPAC Name: N-[3-(4-hydroxyphenoxy)-5-nitrophenyl]-3-(3-methoxyphenyl)-1,2-oxazole-5-carboxamide Traditional Name: N-[3-(4-hydroxyphenoxy)-5-nitro-phenyl]-3-(3-methoxyphenyl)isoxazole-5-carboxamide Formula: C23H17N3O7 MolecularWeight: 447.39698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=C2)C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=C2)C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O7/c1-31-19-4-2-3-14(9-19)21-13-22(33-25-21)23(28)24-15-10-16(26(29)30)12-20(11-15)32-18-7-5-17(27)6-8-18/h2-13,27H,1H3,(H,24,28)