3-[4-[[3-chloranyl-4-(2-methylpropyl)phenyl]methoxy]phenyl]butanoic acid

Systemtic Name: 3-[4-[[3-chloranyl-4-(2-methylpropyl)phenyl]methoxy]phenyl]butanoic acid Openeye Name: 3-[4-[(3-chloro-4-isobutyl-phenyl)methoxy]phenyl]butanoic acid CAS Name: 3-[4-[[3-chloro-4-(2-methylpropyl)phenyl]methoxy]phenyl]butanoic acid IUPAC Name: 3-[4-[[3-chloro-4-(2-methylpropyl)phenyl]methoxy]phenyl]butanoic acid Traditional Name: 3-[4-(3-chloro-4-isobutyl-benzyl)oxyphenyl]butyric acid Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1)COC2=CC=C(C=C2)C(C)CC(=O)O)Cl

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1)COC2=CC=C(C=C2)C(C)CC(=O)O)Cl

InChI

InChI=1S/C21H25ClO3/c1-14(2)10-18-5-4-16(12-20(18)22)13-25-19-8-6-17(7-9-19)15(3)11-21(23)24/h4-9,12,14-15H,10-11,13H2,1-3H3,(H,23,24)