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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O6/c1-2-13-6-9-20-18(10-13)24-22(32-20)14-4-3-5-15(11-14)23-21(27)17-8-7-16(25(28)29)12-19(17)26(30)31/h3-12H,2H2,1H3,(H,23,27)