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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-acetamide Formula: C15H11N3O4S MolecularWeight: 329.33054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O4S/c19-14(9-22-11-4-2-1-3-5-11)17-15-16-12-7-6-10(18(20)21)8-13(12)23-15/h1-8H,9H2,(H,16,17,19)