4-(4-butan-2-ylphenyl)-2-chloranyl-butanoic acid

Systemtic Name: 4-(4-butan-2-ylphenyl)-2-chloranyl-butanoic acid Openeye Name: 2-chloro-4-(4-sec-butylphenyl)butanoic acid CAS Name: 4-(4-butan-2-ylphenyl)-2-chlorobutanoic acid IUPAC Name: 4-(4-butan-2-ylphenyl)-2-chlorobutanoic acid Traditional Name: 2-chloro-4-(4-sec-butylphenyl)butyric acid Formula: C14H19ClO2 MolecularWeight: 254.75246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)CCC(C(=O)O)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)CCC(C(=O)O)Cl

InChI

InChI=1S/C14H19ClO2/c1-3-10(2)12-7-4-11(5-8-12)6-9-13(15)14(16)17/h4-5,7-8,10,13H,3,6,9H2,1-2H3,(H,16,17)