1'-methyl-4-nitro-spiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]-7-sulfonamide

Systemtic Name: 1'-methyl-4-nitro-spiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]-7-sulfonamide Openeye Name: 1'-methyl-4-nitro-spiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]-7-sulfonamide CAS Name: 1'-methyl-4-nitro-7-spiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]sulfonamide IUPAC Name: 1'-methyl-4-nitrospiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]-7-sulfonamide Traditional Name: 1'-methyl-4-nitro-spiro[bicyclo[3.1.1]hepta-1(7),2,4-triene-6,2'-piperidine]-7-sulfonamide Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC12C3=C(C2=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CN1CCCCC12C3=C(C2=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C12H15N3O4S/c1-14-7-3-2-6-12(14)8-4-5-9(15(16)17)10(12)11(8)20(13,18)19/h4-5H,2-3,6-7H2,1H3,(H2,13,18,19)