2-(4-ethyl-1-oxidanyl-octan-3-yl)oxycarbonylbenzoic acid

Systemtic Name: 2-(4-ethyl-1-oxidanyl-octan-3-yl)oxycarbonylbenzoic acid Openeye Name: 2-[2-ethyl-1-(2-hydroxyethyl)hexoxy]carbonylbenzoic acid CAS Name: 2-[(4-ethyl-1-hydroxyoctan-3-yl)oxy-oxomethyl]benzoic acid IUPAC Name: 2-(4-ethyl-1-hydroxyoctan-3-yl)oxycarbonylbenzoic acid Traditional Name: 2-[2-ethyl-1-(2-hydroxyethyl)hexoxy]carbonylbenzoic acid Formula: C18H26O5 MolecularWeight: 322.39604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(CCO)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCC(CC)C(CCO)OC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C18H26O5/c1-3-5-8-13(4-2)16(11-12-19)23-18(22)15-10-7-6-9-14(15)17(20)21/h6-7,9-10,13,16,19H,3-5,8,11-12H2,1-2H3,(H,20,21)