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

Systemtic Name: N-[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide CAS Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitrobenzamide Traditional Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,5-dinitro-benzamide Formula: C20H11ClN4O6 MolecularWeight: 438.77754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H11ClN4O6/c21-12-5-6-18-17(9-12)23-20(31-18)15-3-1-2-4-16(15)22-19(26)11-7-13(24(27)28)10-14(8-11)25(29)30/h1-10H,(H,22,26)