1-(4-nitro-1,3-benzothiazol-5-yl)piperidin-4-one

Systemtic Name: 1-(4-nitro-1,3-benzothiazol-5-yl)piperidin-4-one Openeye Name: 1-(4-nitro-1,3-benzothiazol-5-yl)piperidin-4-one CAS Name: 1-(4-nitro-1,3-benzothiazol-5-yl)-4-piperidinone IUPAC Name: 1-(4-nitro-1,3-benzothiazol-5-yl)piperidin-4-one Traditional Name: 1-(4-nitro-1,3-benzothiazol-5-yl)-4-piperidone Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1=O)C2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O3S/c16-8-3-5-14(6-4-8)9-1-2-10-11(13-7-19-10)12(9)15(17)18/h1-2,7H,3-6H2