N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide Formula: C22H16ClN3O5 MolecularWeight: 437.83254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H16ClN3O5/c1-13-2-3-14(10-18(13)23)22-25-19-11-15(4-9-20(19)31-22)24-21(27)12-30-17-7-5-16(6-8-17)26(28)29/h2-11H,12H2,1H3,(H,24,27)