3-methyl-2-oxidanyl-5-(2-phenylbutanoyl)benzoic acid

Systemtic Name: 3-methyl-2-oxidanyl-5-(2-phenylbutanoyl)benzoic acid Openeye Name: 2-hydroxy-3-methyl-5-(2-phenylbutanoyl)benzoic acid CAS Name: 2-hydroxy-3-methyl-5-(1-oxo-2-phenylbutyl)benzoic acid IUPAC Name: 2-hydroxy-3-methyl-5-(2-phenylbutanoyl)benzoic acid Traditional Name: 2-hydroxy-3-methyl-5-(2-phenylbutanoyl)benzoic acid Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)C2=CC(=C(C(=C2)C)O)C(=O)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)C2=CC(=C(C(=C2)C)O)C(=O)O

InChI

InChI=1S/C18H18O4/c1-3-14(12-7-5-4-6-8-12)17(20)13-9-11(2)16(19)15(10-13)18(21)22/h4-10,14,19H,3H2,1-2H3,(H,21,22)