2-[(3-bromanyl-4-methyl-phenoxy)carbonyl-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]ethanoic acid

Systemtic Name: 2-[(3-bromanyl-4-methyl-phenoxy)carbonyl-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]ethanoic acid Openeye Name: 2-[(3-bromo-4-methyl-phenoxy)carbonyl-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid CAS Name: 2-[[(3-bromo-4-methylphenoxy)-oxomethyl]-[[3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methyl]amino]acetic acid IUPAC Name: 2-[(3-bromo-4-methylphenoxy)carbonyl-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid Traditional Name: 2-[(3-bromo-4-methyl-phenoxy)carbonyl-[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzyl]amino]acetic acid Formula: C29H27BrN2O6 MolecularWeight: 579.43848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)N(CC2=CC(=CC=C2)OCCC3=C(OC(=N3)C4=CC=CC=C4)C)CC(=O)O)Br

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)N(CC2=CC(=CC=C2)OCCC3=C(OC(=N3)C4=CC=CC=C4)C)CC(=O)O)Br

InChI

InChI=1S/C29H27BrN2O6/c1-19-11-12-24(16-25(19)30)38-29(35)32(18-27(33)34)17-21-7-6-10-23(15-21)36-14-13-26-20(2)37-28(31-26)22-8-4-3-5-9-22/h3-12,15-16H,13-14,17-18H2,1-2H3,(H,33,34)