methyl 2-[(4-methylphenyl)sulfonylamino]-6-(quinolin-8-ylsulfonylamino)hexanoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-(quinolin-8-ylsulfonylamino)hexanoate Openeye Name: methyl 2-(p-tolylsulfonylamino)-6-(8-quinolylsulfonylamino)hexanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-6-(8-quinolinylsulfonylamino)hexanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-(quinolin-8-ylsulfonylamino)hexanoate Traditional Name: 6-(8-quinolylsulfonylamino)-2-(tosylamino)hexanoic acid methyl ester Formula: C23H27N3O6S2 MolecularWeight: 505.60698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)OC

InChI

InChI=1S/C23H27N3O6S2/c1-17-11-13-19(14-12-17)33(28,29)26-20(23(27)32-2)9-3-4-16-25-34(30,31)21-10-5-7-18-8-6-15-24-22(18)21/h5-8,10-15,20,25-26H,3-4,9,16H2,1-2H3