2-bromanyl-N-[4-chloranyl-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitro-benzamide

Systemtic Name: 2-bromanyl-N-[4-chloranyl-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitro-benzamide Openeye Name: 2-bromo-N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitro-benzamide CAS Name: 2-bromo-N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide IUPAC Name: 2-bromo-N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide Traditional Name: 2-bromo-N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitro-benzamide Formula: C22H15BrClN3O4 MolecularWeight: 500.7292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br)Cl)C

InChI

InChI=1S/C22H15BrClN3O4/c1-11-7-12(2)20-19(8-11)26-22(31-20)16-9-13(3-6-18(16)24)25-21(28)15-10-14(27(29)30)4-5-17(15)23/h3-10H,1-2H3,(H,25,28)