3-butyl-5-(2-hydroxyphenyl)carbonyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-butyl-5-(2-hydroxyphenyl)carbonyl-2-oxidanyl-benzoic acid Openeye Name: 3-butyl-2-hydroxy-5-(2-hydroxybenzoyl)benzoic acid CAS Name: 3-butyl-2-hydroxy-5-[(2-hydroxyphenyl)-oxomethyl]benzoic acid IUPAC Name: 3-butyl-2-hydroxy-5-(2-hydroxybenzoyl)benzoic acid Traditional Name: 3-butyl-2-hydroxy-5-salicyloyl-benzoic acid Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1O)C(=O)O)C(=O)C2=CC=CC=C2O

Isomeric SMILES

CCCCC1=CC(=CC(=C1O)C(=O)O)C(=O)C2=CC=CC=C2O

InChI

InChI=1S/C18H18O5/c1-2-3-6-11-9-12(10-14(16(11)20)18(22)23)17(21)13-7-4-5-8-15(13)19/h4-5,7-10,19-20H,2-3,6H2,1H3,(H,22,23)