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

Systemtic Name: N-[3-(1,3-benzoxazol-2-yl)-4-chloranyl-phenyl]-2,4-dinitro-benzamide Openeye Name: N-[3-(1,3-benzoxazol-2-yl)-4-chloro-phenyl]-2,4-dinitro-benzamide CAS Name: N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-2,4-dinitrobenzamide IUPAC Name: N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-2,4-dinitrobenzamide Traditional Name: N-[3-(1,3-benzoxazol-2-yl)-4-chloro-phenyl]-2,4-dinitro-benzamide Formula: C20H11ClN4O6 MolecularWeight: 438.77754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

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