2-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-nitro-2-oxidanyl-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-nitro-2-oxidanyl-phenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-hydroxy-4-nitro-phenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-hydroxy-4-nitrophenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-hydroxy-4-nitrophenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-hydroxy-4-nitro-phenyl)acetamide Formula: C15H11N3O5S MolecularWeight: 345.32994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C15H11N3O5S/c19-12-7-9(18(21)22)5-6-10(12)16-14(20)8-24-15-17-11-3-1-2-4-13(11)23-15/h1-7,19H,8H2,(H,16,20)