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

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Formula: C21H21NO3S2 MolecularWeight: 399.52634

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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)C5SCCS5

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C5SCCS5

InChI

InChI=1S/C21H21NO3S2/c23-19(14-3-5-15(6-4-14)20-26-11-12-27-20)22-16-7-8-17-18(13-16)25-21(24-17)9-1-2-10-21/h3-8,13,20H,1-2,9-12H2,(H,22,23)