4-chloranyl-4-(2-pentylphenyl)butanoic acid

Systemtic Name: 4-chloranyl-4-(2-pentylphenyl)butanoic acid Openeye Name: 4-chloro-4-(2-pentylphenyl)butanoic acid CAS Name: 4-chloro-4-(2-pentylphenyl)butanoic acid IUPAC Name: 4-chloro-4-(2-pentylphenyl)butanoic acid Traditional Name: 4-(2-amylphenyl)-4-chloro-butyric acid Formula: C15H21ClO2 MolecularWeight: 268.77904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C(CCC(=O)O)Cl

Isomeric SMILES

CCCCCC1=CC=CC=C1C(CCC(=O)O)Cl

InChI

InChI=1S/C15H21ClO2/c1-2-3-4-7-12-8-5-6-9-13(12)14(16)10-11-15(17)18/h5-6,8-9,14H,2-4,7,10-11H2,1H3,(H,17,18)