2-heptadecoxycarbonylbenzoic acid

Systemtic Name: 2-heptadecoxycarbonylbenzoic acid Openeye Name: 2-heptadecoxycarbonylbenzoic acid CAS Name: 2-[heptadecoxy(oxo)methyl]benzoic acid IUPAC Name: 2-heptadecoxycarbonylbenzoic acid Traditional Name: 2-heptadecoxycarbonylbenzoic acid Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C25H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-29-25(28)23-20-17-16-19-22(23)24(26)27/h16-17,19-20H,2-15,18,21H2,1H3,(H,26,27)