8-[1-(8-oxidanyl-8-oxidanylidene-octyl)-6,7-dipentyl-5,6,7,8-tetrahydronaphthalen-2-yl]octanoic acid

Systemtic Name: 8-[1-(8-oxidanyl-8-oxidanylidene-octyl)-6,7-dipentyl-5,6,7,8-tetrahydronaphthalen-2-yl]octanoic acid Openeye Name: 8-[5-(8-hydroxy-8-oxo-octyl)-2,3-dipentyl-tetralin-6-yl]octanoic acid CAS Name: 8-[1-(8-hydroxy-8-oxooctyl)-6,7-dipentyl-5,6,7,8-tetrahydronaphthalen-2-yl]octanoic acid IUPAC Name: 8-[1-(8-hydroxy-8-oxooctyl)-6,7-dipentyl-5,6,7,8-tetrahydronaphthalen-2-yl]octanoic acid Traditional Name: 8-[2,3-diamyl-5-(8-hydroxy-8-keto-octyl)tetralin-6-yl]caprylic acid Formula: C36H60O4 MolecularWeight: 556.8592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC2=C(CC1CCCCC)C(=C(C=C2)CCCCCCCC(=O)O)CCCCCCCC(=O)O

Isomeric SMILES

CCCCCC1CC2=C(CC1CCCCC)C(=C(C=C2)CCCCCCCC(=O)O)CCCCCCCC(=O)O

InChI

InChI=1S/C36H60O4/c1-3-5-13-20-30-27-32-26-25-29(19-15-9-7-11-17-23-35(37)38)33(22-16-10-8-12-18-24-36(39)40)34(32)28-31(30)21-14-6-4-2/h25-26,30-31H,3-24,27-28H2,1-2H3,(H,37,38)(H,39,40)