(E)-N-(6-nitro-1,3-benzothiazol-2-yl)but-2-enamide

Systemtic Name: (E)-N-(6-nitro-1,3-benzothiazol-2-yl)but-2-enamide Openeye Name: (E)-N-(6-nitro-1,3-benzothiazol-2-yl)but-2-enamide CAS Name: (E)-N-(6-nitro-1,3-benzothiazol-2-yl)-2-butenamide IUPAC Name: (E)-N-(6-nitro-1,3-benzothiazol-2-yl)but-2-enamide Traditional Name: (E)-N-(6-nitro-1,3-benzothiazol-2-yl)but-2-enamide Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C/C=C/C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O3S/c1-2-3-10(15)13-11-12-8-5-4-7(14(16)17)6-9(8)18-11/h2-6H,1H3,(H,12,13,15)/b3-2+