4-[5-(4-carboxyphenyl)-3-oxidanyl-pentyl]benzoic acid

Systemtic Name: 4-[5-(4-carboxyphenyl)-3-oxidanyl-pentyl]benzoic acid Openeye Name: 4-[5-(4-carboxyphenyl)-3-hydroxy-pentyl]benzoic acid CAS Name: 4-[5-(4-carboxyphenyl)-3-hydroxypentyl]benzoic acid IUPAC Name: 4-[5-(4-carboxyphenyl)-3-hydroxypentyl]benzoic acid Traditional Name: 4-[5-(4-carboxyphenyl)-3-hydroxy-pentyl]benzoic acid Formula: C19H20O5 MolecularWeight: 328.3591

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(CCC2=CC=C(C=C2)C(=O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC(CCC2=CC=C(C=C2)C(=O)O)O)C(=O)O

InChI

InChI=1S/C19H20O5/c20-17(11-5-13-1-7-15(8-2-13)18(21)22)12-6-14-3-9-16(10-4-14)19(23)24/h1-4,7-10,17,20H,5-6,11-12H2,(H,21,22)(H,23,24)