2-octan-3-yloxycarbonyl-6-phenyl-benzoic acid

Systemtic Name: 2-octan-3-yloxycarbonyl-6-phenyl-benzoic acid Openeye Name: 2-(1-ethylhexoxycarbonyl)-6-phenyl-benzoic acid CAS Name: 2-[octan-3-yloxy(oxo)methyl]-6-phenylbenzoic acid IUPAC Name: 2-octan-3-yloxycarbonyl-6-phenylbenzoic acid Traditional Name: 2-(1-ethylhexoxycarbonyl)-6-phenyl-benzoic acid Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC=CC(=C1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C22H26O4/c1-3-5-7-13-17(4-2)26-22(25)19-15-10-14-18(20(19)21(23)24)16-11-8-6-9-12-16/h6,8-12,14-15,17H,3-5,7,13H2,1-2H3,(H,23,24)