5-chloranyl-N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide Openeye Name: 5-chloro-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide CAS Name: 5-chloro-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitrobenzamide Traditional Name: 5-chloro-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-nitro-benzamide Formula: C21H13Cl2N3O4 MolecularWeight: 442.25162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H13Cl2N3O4/c1-11-2-6-17-19(8-11)30-21(25-17)14-10-13(4-5-16(14)23)24-20(27)15-9-12(22)3-7-18(15)26(28)29/h2-10H,1H3,(H,24,27)