ditert-butyl 1-(4-methylphenyl)sulfonyl-2H-quinoline-2,3-dicarboxylate

Systemtic Name: ditert-butyl 1-(4-methylphenyl)sulfonyl-2H-quinoline-2,3-dicarboxylate Openeye Name: ditert-butyl 1-(p-tolylsulfonyl)-2H-quinoline-2,3-dicarboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2H-quinoline-2,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 1-(4-methylphenyl)sulfonyl-2H-quinoline-2,3-dicarboxylate Traditional Name: 1-tosyl-2H-quinoline-2,3-dicarboxylic acid ditert-butyl ester Formula: C26H31NO6S MolecularWeight: 485.59244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C(=CC3=CC=CC=C32)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C(=CC3=CC=CC=C32)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H31NO6S/c1-17-12-14-19(15-13-17)34(30,31)27-21-11-9-8-10-18(21)16-20(23(28)32-25(2,3)4)22(27)24(29)33-26(5,6)7/h8-16,22H,1-7H3