2-(2,4-dinitrophenoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-6-yl]ethanamide

Systemtic Name: 2-(2,4-dinitrophenoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-6-yl]ethanamide Openeye Name: 2-(2,4-dinitrophenoxy)-N-[2-(o-tolyl)-1,3-benzoxazol-6-yl]acetamide CAS Name: 2-(2,4-dinitrophenoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-6-yl]acetamide IUPAC Name: 2-(2,4-dinitrophenoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-6-yl]acetamide Traditional Name: 2-(2,4-dinitrophenoxy)-N-[2-(o-tolyl)-1,3-benzoxazol-6-yl]acetamide Formula: C22H16N4O7 MolecularWeight: 448.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(O2)C=C(C=C3)NC(=O)COC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(O2)C=C(C=C3)NC(=O)COC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O7/c1-13-4-2-3-5-16(13)22-24-17-8-6-14(10-20(17)33-22)23-21(27)12-32-19-9-7-15(25(28)29)11-18(19)26(30)31/h2-11H,12H2,1H3,(H,23,27)