4-(3-ethylpentan-3-yl)benzoic acid

Systemtic Name: 4-(3-ethylpentan-3-yl)benzoic acid Openeye Name: 4-(1,1-diethylpropyl)benzoic acid CAS Name: 4-(3-ethylpentan-3-yl)benzoic acid IUPAC Name: 4-(3-ethylpentan-3-yl)benzoic acid Traditional Name: 4-(1,1-diethylpropyl)benzoic acid Formula: C14H20O2 MolecularWeight: 220.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O2/c1-4-14(5-2,6-3)12-9-7-11(8-10-12)13(15)16/h7-10H,4-6H2,1-3H3,(H,15,16)