3-[(4-chlorophenyl)methyl]-4-ethoxy-4-oxidanylidene-3-(4-propan-2-ylphenoxy)butanoic acid

Systemtic Name: 3-[(4-chlorophenyl)methyl]-4-ethoxy-4-oxidanylidene-3-(4-propan-2-ylphenoxy)butanoic acid Openeye Name: 3-[(4-chlorophenyl)methyl]-4-ethoxy-3-(4-isopropylphenoxy)-4-oxo-butanoic acid CAS Name: 3-[(4-chlorophenyl)methyl]-4-ethoxy-4-oxo-3-(4-propan-2-ylphenoxy)butanoic acid IUPAC Name: 3-[(4-chlorophenyl)methyl]-4-ethoxy-4-oxo-3-(4-propan-2-ylphenoxy)butanoic acid Traditional Name: 3-(4-chlorobenzyl)-4-ethoxy-3-(4-isopropylphenoxy)-4-keto-butyric acid Formula: C22H25ClO5 MolecularWeight: 404.8839

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)Cl)(CC(=O)O)OC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)Cl)(CC(=O)O)OC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C22H25ClO5/c1-4-27-21(26)22(14-20(24)25,13-16-5-9-18(23)10-6-16)28-19-11-7-17(8-12-19)15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,24,25)