3-henicosylphthalic acid

Systemtic Name: 3-henicosylphthalic acid Openeye Name: 3-henicosylphthalic acid CAS Name: 3-heneicosylphthalic acid IUPAC Name: 3-henicosylphthalic acid Traditional Name: 3-heneicosylphthalic acid Formula: C29H48O4 MolecularWeight: 460.68902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)O

InChI

InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-23-21-24-26(28(30)31)27(25)29(32)33/h21,23-24H,2-20,22H2,1H3,(H,30,31)(H,32,33)