4-(4-ethanoyl-8-oxidanyl-9-propoxy-nonyl)benzoic acid

Systemtic Name: 4-(4-ethanoyl-8-oxidanyl-9-propoxy-nonyl)benzoic acid Openeye Name: 4-(4-acetyl-8-hydroxy-9-propoxy-nonyl)benzoic acid CAS Name: 4-(4-acetyl-8-hydroxy-9-propoxynonyl)benzoic acid IUPAC Name: 4-(4-acetyl-8-hydroxy-9-propoxynonyl)benzoic acid Traditional Name: 4-(4-acetyl-8-hydroxy-9-propoxy-nonyl)benzoic acid Formula: C21H32O5 MolecularWeight: 364.47578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(=O)C)O

Isomeric SMILES

CCCOCC(CCCC(CCCC1=CC=C(C=C1)C(=O)O)C(=O)C)O

InChI

InChI=1S/C21H32O5/c1-3-14-26-15-20(23)9-5-8-18(16(2)22)7-4-6-17-10-12-19(13-11-17)21(24)25/h10-13,18,20,23H,3-9,14-15H2,1-2H3,(H,24,25)