(7-chloranyl-3-methoxy-4-octanoyloxy-naphthalen-1-yl) octanoate

Systemtic Name: (7-chloranyl-3-methoxy-4-octanoyloxy-naphthalen-1-yl) octanoate Openeye Name: (7-chloro-3-methoxy-4-octanoyloxy-1-naphthyl) octanoate CAS Name: octanoic acid [7-chloro-3-methoxy-4-(1-oxooctoxy)-1-naphthalenyl] ester IUPAC Name: (7-chloro-3-methoxy-4-octanoyloxynaphthalen-1-yl) octanoate Traditional Name: caprylic acid (4-caprylyloxy-7-chloro-3-methoxy-1-naphthyl) ester Formula: C27H37ClO5 MolecularWeight: 477.03268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37ClO5/c1-4-6-8-10-12-14-25(29)32-23-19-24(31-3)27(21-17-16-20(28)18-22(21)23)33-26(30)15-13-11-9-7-5-2/h16-19H,4-15H2,1-3H3