3-ethyl-6-octyl-2-pentoxycarbonyl-benzoic acid

Systemtic Name: 3-ethyl-6-octyl-2-pentoxycarbonyl-benzoic acid Openeye Name: 3-ethyl-6-octyl-2-pentoxycarbonyl-benzoic acid CAS Name: 3-ethyl-6-octyl-2-[oxo(pentoxy)methyl]benzoic acid IUPAC Name: 3-ethyl-6-octyl-2-pentoxycarbonylbenzoic acid Traditional Name: 2-amoxycarbonyl-3-ethyl-6-octyl-benzoic acid Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C=C1)CC)C(=O)OCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C=C1)CC)C(=O)OCCCCC)C(=O)O

InChI

InChI=1S/C23H36O4/c1-4-7-9-10-11-12-14-19-16-15-18(6-3)21(20(19)22(24)25)23(26)27-17-13-8-5-2/h15-16H,4-14,17H2,1-3H3,(H,24,25)