2-octoxycarbonyl-6-octyl-benzoic acid

Systemtic Name: 2-octoxycarbonyl-6-octyl-benzoic acid Openeye Name: 2-octoxycarbonyl-6-octyl-benzoic acid CAS Name: 2-[octoxy(oxo)methyl]-6-octylbenzoic acid IUPAC Name: 2-octoxycarbonyl-6-octylbenzoic acid Traditional Name: 2-octoxycarbonyl-6-octyl-benzoic acid Formula: C24H38O4 MolecularWeight: 390.55612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)OCCCCCCCC

InChI

InChI=1S/C24H38O4/c1-3-5-7-9-11-13-16-20-17-15-18-21(22(20)23(25)26)24(27)28-19-14-12-10-8-6-4-2/h15,17-18H,3-14,16,19H2,1-2H3,(H,25,26)