dimethyl 1-(4-methylphenyl)sulfonyl-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylate

Systemtic Name: dimethyl 1-(4-methylphenyl)sulfonyl-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylate Openeye Name: dimethyl 1-(p-tolylsulfonyl)-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(4-methylphenyl)sulfonyl-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylate Traditional Name: 1-tosyl-3,4,4a,7-tetrahydro-2H-quinoline-5,6-dicarboxylic acid dimethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3C2=CCC(=C3C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3C2=CCC(=C3C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H23NO6S/c1-13-6-8-14(9-7-13)28(24,25)21-12-4-5-15-17(21)11-10-16(19(22)26-2)18(15)20(23)27-3/h6-9,11,15H,4-5,10,12H2,1-3H3