2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[[3-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]phenyl]methyl]amino]ethanoic acid

Systemtic Name: 2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[[3-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]phenyl]methyl]amino]ethanoic acid Openeye Name: 2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[[3-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methoxy]phenyl]methyl]amino]acetic acid CAS Name: 2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[[3-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methoxy]phenyl]methyl]amino]acetic acid IUPAC Name: 2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[[3-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]phenyl]methyl]amino]acetic acid Traditional Name: 2-[3,4-dihydro-2H-quinolin-1-ylsulfonyl-[3-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methoxy]benzyl]amino]acetic acid Formula: C30H31N3O6S MolecularWeight: 561.64864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)C)COC3=CC=CC(=C3)CN(CC(=O)O)S(=O)(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)C)COC3=CC=CC(=C3)CN(CC(=O)O)S(=O)(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C30H31N3O6S/c1-21-12-14-25(15-13-21)30-31-27(22(2)39-30)20-38-26-10-5-7-23(17-26)18-32(19-29(34)35)40(36,37)33-16-6-9-24-8-3-4-11-28(24)33/h3-5,7-8,10-15,17H,6,9,16,18-20H2,1-2H3,(H,34,35)