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

Systemtic Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: 2-(2-nitrophenoxy)-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]acetamide CAS Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: 2-(2-nitrophenoxy)-N-[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]acetamide Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O5/c1-3-16(2)18-10-13-22-20(14-18)27-25(33-22)17-8-11-19(12-9-17)26-24(29)15-32-23-7-5-4-6-21(23)28(30)31/h4-14,16H,3,15H2,1-2H3,(H,26,29)