3-chloranyl-4-(4-pentylphenyl)butanoic acid

Systemtic Name: 3-chloranyl-4-(4-pentylphenyl)butanoic acid Openeye Name: 3-chloro-4-(4-pentylphenyl)butanoic acid CAS Name: 3-chloro-4-(4-pentylphenyl)butanoic acid IUPAC Name: 3-chloro-4-(4-pentylphenyl)butanoic acid Traditional Name: 4-(4-amylphenyl)-3-chloro-butyric acid Formula: C15H21ClO2 MolecularWeight: 268.77904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)CC(CC(=O)O)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)CC(CC(=O)O)Cl

InChI

InChI=1S/C15H21ClO2/c1-2-3-4-5-12-6-8-13(9-7-12)10-14(16)11-15(17)18/h6-9,14H,2-5,10-11H2,1H3,(H,17,18)