3-(2-carboxyethyloxy)-3-(7-dodecylnaphthalen-1-yl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(2-carboxyethyloxy)-3-(7-dodecylnaphthalen-1-yl)-2-oxidanyl-propanoic acid Openeye Name: 3-(2-carboxyethyloxy)-3-(7-dodecyl-1-naphthyl)-2-hydroxy-propanoic acid CAS Name: 3-(2-carboxyethyloxy)-3-(7-dodecyl-1-naphthalenyl)-2-hydroxypropanoic acid IUPAC Name: 3-(2-carboxyethyloxy)-3-(7-dodecylnaphthalen-1-yl)-2-hydroxypropanoic acid Traditional Name: 3-(2-carboxyethyloxy)-2-hydroxy-3-(7-lauryl-1-naphthyl)propionic acid Formula: C28H40O6 MolecularWeight: 472.6136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC2=C(C=CC=C2C(C(C(=O)O)O)OCCC(=O)O)C=C1

Isomeric SMILES

CCCCCCCCCCCCC1=CC2=C(C=CC=C2C(C(C(=O)O)O)OCCC(=O)O)C=C1

InChI

InChI=1S/C28H40O6/c1-2-3-4-5-6-7-8-9-10-11-13-21-16-17-22-14-12-15-23(24(22)20-21)27(26(31)28(32)33)34-19-18-25(29)30/h12,14-17,20,26-27,31H,2-11,13,18-19H2,1H3,(H,29,30)(H,32,33)