[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2,3-dihydro-1H-indene-5-sulfonate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2,3-dihydro-1H-indene-5-sulfonate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] indane-5-sulfonate CAS Name: 2,3-dihydro-1H-indene-5-sulfonic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2,3-dihydro-1H-indene-5-sulfonate Traditional Name: indane-5-sulfonic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C19H20O4S3 MolecularWeight: 408.5547

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OS(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OS(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C19H20O4S3/c1-22-18-12-15(19-24-9-10-25-19)6-8-17(18)23-26(20,21)16-7-5-13-3-2-4-14(13)11-16/h5-8,11-12,19H,2-4,9-10H2,1H3