N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide Openeye Name: N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide CAS Name: N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitrobenzamide Traditional Name: N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide Formula: C21H13ClN4O6 MolecularWeight: 452.80412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H13ClN4O6/c1-11-17(25(28)29)8-12(9-18(11)26(30)31)20(27)23-13-6-7-19-16(10-13)24-21(32-19)14-4-2-3-5-15(14)22/h2-10H,1H3,(H,23,27)