4-[2-(2-methylbutyl)phenyl]benzoic acid

Systemtic Name: 4-[2-(2-methylbutyl)phenyl]benzoic acid Openeye Name: 4-[2-(2-methylbutyl)phenyl]benzoic acid CAS Name: 4-[2-(2-methylbutyl)phenyl]benzoic acid IUPAC Name: 4-[2-(2-methylbutyl)phenyl]benzoic acid Traditional Name: 4-[2-(2-methylbutyl)phenyl]benzoic acid Formula: C18H20O2 MolecularWeight: 268.3502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=CC=CC=C1C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)CC1=CC=CC=C1C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H20O2/c1-3-13(2)12-16-6-4-5-7-17(16)14-8-10-15(11-9-14)18(19)20/h4-11,13H,3,12H2,1-2H3,(H,19,20)