2-[4-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]carbonylamino]phenyl]propanoic acid

Systemtic Name: 2-[4-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]carbonylamino]phenyl]propanoic acid Openeye Name: 2-[4-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-3,4-dihydro-2H-quinoline-7-carbonyl]amino]phenyl]propanoic acid CAS Name: 2-[4-[[[1-(2-methoxy-5-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-oxomethyl]amino]phenyl]propanoic acid IUPAC Name: 2-[4-[[1-(2-methoxy-5-methylphenyl)sulfonyl-3,4-dihydro-2H-quinoline-7-carbonyl]amino]phenyl]propanoic acid Traditional Name: 2-[4-[[1-(2-methoxy-5-methyl-phenyl)sulfonyl-3,4-dihydro-2H-quinoline-7-carbonyl]amino]phenyl]propionic acid Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC3=C2C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC3=C2C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(C)C(=O)O

InChI

InChI=1S/C27H28N2O6S/c1-17-6-13-24(35-3)25(15-17)36(33,34)29-14-4-5-20-7-8-21(16-23(20)29)26(30)28-22-11-9-19(10-12-22)18(2)27(31)32/h6-13,15-16,18H,4-5,14H2,1-3H3,(H,28,30)(H,31,32)