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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenyl-ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenyl-acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenylacetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenylacetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenyl-acetamide Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O3S/c19-14(8-10-4-2-1-3-5-10)17-15-16-12-7-6-11(18(20)21)9-13(12)22-15/h1-7,9H,8H2,(H,16,17,19)