18-(1-chloranylnaphthalen-2-yl)octadecanoic acid

Systemtic Name: 18-(1-chloranylnaphthalen-2-yl)octadecanoic acid Openeye Name: 18-(1-chloro-2-naphthyl)octadecanoic acid CAS Name: 18-(1-chloro-2-naphthalenyl)octadecanoic acid IUPAC Name: 18-(1-chloronaphthalen-2-yl)octadecanoic acid Traditional Name: 18-(1-chloro-2-naphthyl)stearic acid Formula: C28H41ClO2 MolecularWeight: 445.07694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2Cl)CCCCCCCCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2Cl)CCCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C28H41ClO2/c29-28-25(23-22-24-18-16-17-20-26(24)28)19-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-21-27(30)31/h16-18,20,22-23H,1-15,19,21H2,(H,30,31)