3-ethyl-4-methoxy-5-(2,4,4-trimethylpentan-2-yl)benzoic acid

Systemtic Name: 3-ethyl-4-methoxy-5-(2,4,4-trimethylpentan-2-yl)benzoic acid Openeye Name: 3-ethyl-4-methoxy-5-(1,1,3,3-tetramethylbutyl)benzoic acid CAS Name: 3-ethyl-4-methoxy-5-(2,4,4-trimethylpentan-2-yl)benzoic acid IUPAC Name: 3-ethyl-4-methoxy-5-(2,4,4-trimethylpentan-2-yl)benzoic acid Traditional Name: 3-ethyl-4-methoxy-5-(1,1,3,3-tetramethylbutyl)benzoic acid Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C(=O)O)C(C)(C)CC(C)(C)C)OC

Isomeric SMILES

CCC1=C(C(=CC(=C1)C(=O)O)C(C)(C)CC(C)(C)C)OC

InChI

InChI=1S/C18H28O3/c1-8-12-9-13(16(19)20)10-14(15(12)21-7)18(5,6)11-17(2,3)4/h9-10H,8,11H2,1-7H3,(H,19,20)