N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloranyl-4-nitro-benzamide

Systemtic Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloranyl-4-nitro-benzamide Openeye Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloro-4-nitro-benzamide CAS Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloro-4-nitrobenzamide IUPAC Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloro-4-nitrobenzamide Traditional Name: N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-2-chloro-4-nitro-benzamide Formula: C24H20ClN3O4 MolecularWeight: 449.8863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20ClN3O4/c1-24(2,3)15-6-4-14(5-7-15)23-27-20-12-16(8-11-21(20)32-23)26-22(29)18-10-9-17(28(30)31)13-19(18)25/h4-13H,1-3H3,(H,26,29)