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

Systemtic Name: 3-bromanyl-4-methoxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide Openeye Name: 3-bromo-4-methoxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide CAS Name: 3-bromo-4-methoxy-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzenesulfonamide IUPAC Name: 3-bromo-4-methoxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzenesulfonamide Traditional Name: 3-bromo-4-methoxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzenesulfonamide Formula: C18H18BrNO5S MolecularWeight: 440.30822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)Br

InChI

InChI=1S/C18H18BrNO5S/c1-23-15-7-5-13(11-14(15)19)26(21,22)20-12-4-6-16-17(10-12)25-18(24-16)8-2-3-9-18/h4-7,10-11,20H,2-3,8-9H2,1H3