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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

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