2-[3-chloranyl-4-oxidanyl-5-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl]propanoic acid

Systemtic Name: 2-[3-chloranyl-4-oxidanyl-5-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl]propanoic acid Openeye Name: 2-[3-chloro-4-hydroxy-5-[(E)-3-(4-isopropylphenyl)prop-2-enoyl]phenyl]propanoic acid CAS Name: 2-[3-chloro-4-hydroxy-5-[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]phenyl]propanoic acid IUPAC Name: 2-[3-chloro-4-hydroxy-5-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl]propanoic acid Traditional Name: 2-[3-chloro-4-hydroxy-5-[(E)-3-p-cumenylacryloyl]phenyl]propionic acid Formula: C21H21ClO4 MolecularWeight: 372.84204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)C2=CC(=CC(=C2O)Cl)C(C)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC(=CC(=C2O)Cl)C(C)C(=O)O

InChI

InChI=1S/C21H21ClO4/c1-12(2)15-7-4-14(5-8-15)6-9-19(23)17-10-16(13(3)21(25)26)11-18(22)20(17)24/h4-13,24H,1-3H3,(H,25,26)/b9-6+