(6-chloranyl-2,3-dimethoxy-4-octanoyloxy-naphthalen-1-yl) octanoate

Systemtic Name: (6-chloranyl-2,3-dimethoxy-4-octanoyloxy-naphthalen-1-yl) octanoate Openeye Name: (6-chloro-2,3-dimethoxy-4-octanoyloxy-1-naphthyl) octanoate CAS Name: octanoic acid [6-chloro-2,3-dimethoxy-4-(1-oxooctoxy)-1-naphthalenyl] ester IUPAC Name: (6-chloro-2,3-dimethoxy-4-octanoyloxynaphthalen-1-yl) octanoate Traditional Name: caprylic acid (4-caprylyloxy-6-chloro-2,3-dimethoxy-1-naphthyl) ester Formula: C28H39ClO6 MolecularWeight: 507.05866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)CCCCCCC)OC)OC

Isomeric SMILES

CCCCCCCC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)CCCCCCC)OC)OC

InChI

InChI=1S/C28H39ClO6/c1-5-7-9-11-13-15-23(30)34-25-21-18-17-20(29)19-22(21)26(28(33-4)27(25)32-3)35-24(31)16-14-12-10-8-6-2/h17-19H,5-16H2,1-4H3