N-[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)ethanamide

Systemtic Name: N-[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)ethanamide Openeye Name: N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)acetamide CAS Name: N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)acetamide IUPAC Name: N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)acetamide Traditional Name: N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dinitrophenoxy)acetamide Formula: C21H13ClN4O7 MolecularWeight: 468.80352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)COC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)COC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H13ClN4O7/c22-13-3-7-18-16(9-13)24-21(33-18)12-1-4-14(5-2-12)23-20(27)11-32-19-8-6-15(25(28)29)10-17(19)26(30)31/h1-10H,11H2,(H,23,27)