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

Systemtic Name: 3-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Openeye Name: 3-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide CAS Name: 3-(2-cyanoethylsulfamoyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzamide IUPAC Name: 3-(2-cyanoethylsulfamoyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzamide Traditional Name: 3-(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(=CC=C4)S(=O)(=O)NCCC#N

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O5S/c22-11-4-12-23-30(26,27)17-6-3-5-15(13-17)20(25)24-16-7-8-18-19(14-16)29-21(28-18)9-1-2-10-21/h3,5-8,13-14,23H,1-2,4,9-10,12H2,(H,24,25)