3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylthiolane 1,1-dioxide

Systemtic Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylthiolane 1,1-dioxide Openeye Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylthiolane 1,1-dioxide CAS Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylthiolane 1,1-dioxide IUPAC Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylthiolane 1,1-dioxide Traditional Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]sulfonylsulfolane Formula: C19H21NO6S3 MolecularWeight: 455.56814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C4CCS(=O)(=O)C4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C4CCS(=O)(=O)C4

InChI

InChI=1S/C19H21NO6S3/c21-27(22)12-10-18(14-27)28(23,24)16-7-3-8-17(13-16)29(25,26)20-11-4-6-15-5-1-2-9-19(15)20/h1-3,5,7-9,13,18H,4,6,10-12,14H2