6-[4-[(4-methylphenyl)sulfonylamino]phenyl]-6-pyridin-3-yl-hexanoic acid

Systemtic Name: 6-[4-[(4-methylphenyl)sulfonylamino]phenyl]-6-pyridin-3-yl-hexanoic acid Openeye Name: 6-[4-(p-tolylsulfonylamino)phenyl]-6-(3-pyridyl)hexanoic acid CAS Name: 6-[4-[(4-methylphenyl)sulfonylamino]phenyl]-6-(3-pyridinyl)hexanoic acid IUPAC Name: 6-[4-[(4-methylphenyl)sulfonylamino]phenyl]-6-pyridin-3-ylhexanoic acid Traditional Name: 6-(3-pyridyl)-6-[4-(tosylamino)phenyl]hexanoic acid Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(CCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(CCCCC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C24H26N2O4S/c1-18-8-14-22(15-9-18)31(29,30)26-21-12-10-19(11-13-21)23(6-2-3-7-24(27)28)20-5-4-16-25-17-20/h4-5,8-17,23,26H,2-3,6-7H2,1H3,(H,27,28)