4-[4-(4-oxidanyl-4-oxidanylidene-butan-2-yl)oxyphenoxy]-2-[(4-phenylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[4-(4-oxidanyl-4-oxidanylidene-butan-2-yl)oxyphenoxy]-2-[(4-phenylphenyl)carbonylamino]butanoic acid Openeye Name: 4-[4-(3-hydroxy-1-methyl-3-oxo-propoxy)phenoxy]-2-[(4-phenylbenzoyl)amino]butanoic acid CAS Name: 4-[4-(4-hydroxy-4-oxobutan-2-yl)oxyphenoxy]-2-[[oxo-(4-phenylphenyl)methyl]amino]butanoic acid IUPAC Name: 4-[4-(4-hydroxy-4-oxobutan-2-yl)oxyphenoxy]-2-[(4-phenylbenzoyl)amino]butanoic acid Traditional Name: 4-[4-(3-hydroxy-3-keto-1-methyl-propoxy)phenoxy]-2-[(4-phenylbenzoyl)amino]butyric acid Formula: C27H27NO7 MolecularWeight: 477.50578

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)OC1=CC=C(C=C1)OCCC(C(=O)O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)O)OC1=CC=C(C=C1)OCCC(C(=O)O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H27NO7/c1-18(17-25(29)30)35-23-13-11-22(12-14-23)34-16-15-24(27(32)33)28-26(31)21-9-7-20(8-10-21)19-5-3-2-4-6-19/h2-14,18,24H,15-17H2,1H3,(H,28,31)(H,29,30)(H,32,33)