4-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide

Systemtic Name: 4-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Openeye Name: 4-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide CAS Name: 4-(2-cyanoethylsulfamoyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzamide IUPAC Name: 4-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzamide Traditional Name: 4-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)NCCC#N

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)NCCC#N

InChI

InChI=1S/C21H21N3O5S/c22-12-3-13-23-30(26,27)17-7-4-15(5-8-17)20(25)24-16-6-9-18-19(14-16)29-21(28-18)10-1-2-11-21/h4-9,14,23H,1-3,10-11,13H2,(H,24,25)