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

Systemtic Name: 4-methyl-N-[2-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide Openeye Name: 4-methyl-N-[2-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide CAS Name: 4-methyl-N-[2-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-methyl-N-[2-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitrobenzamide Traditional Name: 4-methyl-N-[2-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide Formula: C22H16N4O6 MolecularWeight: 432.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3NC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3NC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O6/c1-12-7-8-20-17(9-12)24-22(32-20)15-5-3-4-6-16(15)23-21(27)14-10-18(25(28)29)13(2)19(11-14)26(30)31/h3-11H,1-2H3,(H,23,27)