3-(4-hexadecoxyphenyl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-hexadecoxyphenyl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-hexadecoxyphenyl)-3-oxo-propanoic acid CAS Name: 3-(4-hexadecoxyphenyl)-3-oxopropanoic acid IUPAC Name: 3-(4-hexadecoxyphenyl)-3-oxopropanoic acid Traditional Name: 3-(4-cetyloxyphenyl)-3-keto-propionic acid Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)CC(=O)O

InChI

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