3-[(2-octylphenyl)methyl]phthalic acid

Systemtic Name: 3-[(2-octylphenyl)methyl]phthalic acid Openeye Name: 3-[(2-octylphenyl)methyl]phthalic acid CAS Name: 3-[(2-octylphenyl)methyl]phthalic acid IUPAC Name: 3-[(2-octylphenyl)methyl]phthalic acid Traditional Name: 3-(2-octylbenzyl)phthalic acid Formula: C23H28O4 MolecularWeight: 368.46602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1CC2=CC=CC(=C2C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1CC2=CC=CC(=C2C(=O)O)C(=O)O

InChI

InChI=1S/C23H28O4/c1-2-3-4-5-6-7-11-17-12-8-9-13-18(17)16-19-14-10-15-20(22(24)25)21(19)23(26)27/h8-10,12-15H,2-7,11,16H2,1H3,(H,24,25)(H,26,27)