naphthalen-2-yl 3'-methylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-1-benzofuran]-2'-carboxylate

Systemtic Name: naphthalen-2-yl 3'-methylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-1-benzofuran]-2'-carboxylate Openeye Name: 2-naphthyl 3'-methylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-benzofuran]-2'-carboxylate CAS Name: 3'-methyl-2'-spiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-benzofuran]carboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 3'-methylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-1-benzofuran]-2'-carboxylate Traditional Name: 3'-methylspiro[1,3-dithiolane-2,4'-6,7-dihydro-5H-benzofuran]-2'-carboxylic acid 2-naphthyl ester Formula: C22H20O3S2 MolecularWeight: 396.5224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C3(CCC2)SCCS3)C(=O)OC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(OC2=C1C3(CCC2)SCCS3)C(=O)OC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H20O3S2/c1-14-19-18(7-4-10-22(19)26-11-12-27-22)25-20(14)21(23)24-17-9-8-15-5-2-3-6-16(15)13-17/h2-3,5-6,8-9,13H,4,7,10-12H2,1H3