[8-(2-methyl-2-oxidanyl-heptanoyl)oxy-1,8a-dihydronaphthalen-1-yl] 2-methyl-2-propyl-pentanoate

Systemtic Name: [8-(2-methyl-2-oxidanyl-heptanoyl)oxy-1,8a-dihydronaphthalen-1-yl] 2-methyl-2-propyl-pentanoate Openeye Name: [8-(2-hydroxy-2-methyl-heptanoyl)oxy-1,8a-dihydronaphthalen-1-yl] 2-methyl-2-propyl-pentanoate CAS Name: 2-methyl-2-propylpentanoic acid [8-(2-hydroxy-2-methyl-1-oxoheptoxy)-1,8a-dihydronaphthalen-1-yl] ester IUPAC Name: [8-(2-hydroxy-2-methylheptanoyl)oxy-1,8a-dihydronaphthalen-1-yl] 2-methyl-2-propylpentanoate Traditional Name: 2-methyl-2-propyl-valeric acid [8-(2-hydroxy-2-methyl-heptanoyl)oxy-1,8a-dihydronaphthalen-1-yl] ester Formula: C27H40O5 MolecularWeight: 444.6035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C(=O)OC1=CC=CC2=CC=CC(C21)OC(=O)C(C)(CCC)CCC)O

Isomeric SMILES

CCCCCC(C)(C(=O)OC1=CC=CC2=CC=CC(C21)OC(=O)C(C)(CCC)CCC)O

InChI

InChI=1S/C27H40O5/c1-6-9-10-19-27(5,30)25(29)32-22-16-12-14-20-13-11-15-21(23(20)22)31-24(28)26(4,17-7-2)18-8-3/h11-16,21,23,30H,6-10,17-19H2,1-5H3