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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(C)C)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(C)C)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

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