4-[(4-methylphenyl)sulfonylamino]-2-phenoxy-2-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]butanoic acid

Systemtic Name: 4-[(4-methylphenyl)sulfonylamino]-2-phenoxy-2-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]butanoic acid Openeye Name: 2-phenoxy-4-(p-tolylsulfonylamino)-2-[[3-(2-quinolylmethoxy)phenyl]methoxy]butanoic acid CAS Name: 4-[(4-methylphenyl)sulfonylamino]-2-phenoxy-2-[[3-(2-quinolinylmethoxy)phenyl]methoxy]butanoic acid IUPAC Name: 4-[(4-methylphenyl)sulfonylamino]-2-phenoxy-2-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]butanoic acid Traditional Name: 2-phenoxy-2-[3-(2-quinolylmethoxy)benzyl]oxy-4-(tosylamino)butyric acid Formula: C34H32N2O7S MolecularWeight: 612.69208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(C(=O)O)(OCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(C(=O)O)(OCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)OC5=CC=CC=C5

InChI

InChI=1S/C34H32N2O7S/c1-25-14-18-31(19-15-25)44(39,40)35-21-20-34(33(37)38,43-29-10-3-2-4-11-29)42-23-26-8-7-12-30(22-26)41-24-28-17-16-27-9-5-6-13-32(27)36-28/h2-19,22,35H,20-21,23-24H2,1H3,(H,37,38)