N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)ethanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)acetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)acetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-phenylphenoxy)acetamide Formula: C21H15N3O4S MolecularWeight: 405.4265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4S/c25-20(23-21-22-18-11-8-16(24(26)27)12-19(18)29-21)13-28-17-9-6-15(7-10-17)14-4-2-1-3-5-14/h1-12H,13H2,(H,22,23,25)