4-methyl-3-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6S/c1-12-4-6-14(11-15(12)20(21)22)27(23,24)19-13-5-7-16-17(10-13)26-18(25-16)8-2-3-9-18/h4-7,10-11,19H,2-3,8-9H2,1H3