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

Systemtic Name: 2-[(4-butylphenyl)carbonyl-[[3-[2-(2,5-dimethyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]ethanoic acid Openeye Name: 2-[(4-butylbenzoyl)-[[3-[2-(2,5-dimethyloxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid CAS Name: 2-[[(4-butylphenyl)-oxomethyl]-[[3-[2-(2,5-dimethyl-4-oxazolyl)ethoxy]phenyl]methyl]amino]acetic acid IUPAC Name: 2-[(4-butylbenzoyl)-[[3-[2-(2,5-dimethyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid Traditional Name: 2-[(4-butylbenzoyl)-[3-[2-(2,5-dimethyloxazol-4-yl)ethoxy]benzyl]amino]acetic acid Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)OCCC3=C(OC(=N3)C)C)CC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)OCCC3=C(OC(=N3)C)C)CC(=O)O

InChI

InChI=1S/C27H32N2O5/c1-4-5-7-21-10-12-23(13-11-21)27(32)29(18-26(30)31)17-22-8-6-9-24(16-22)33-15-14-25-19(2)34-20(3)28-25/h6,8-13,16H,4-5,7,14-15,17-18H2,1-3H3,(H,30,31)