2-methyl-2-[8-(2-methyl-2-prop-2-enyl-pent-4-enoyl)oxy-8,8a-dihydronaphthalen-1-yl]-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: 2-methyl-2-[8-(2-methyl-2-prop-2-enyl-pent-4-enoyl)oxy-8,8a-dihydronaphthalen-1-yl]-3,5-bis(oxidanyl)heptanoic acid Openeye Name: 2-[8-(2-allyl-2-methyl-pent-4-enoyl)oxy-8,8a-dihydronaphthalen-1-yl]-3,5-dihydroxy-2-methyl-heptanoic acid CAS Name: 3,5-dihydroxy-2-methyl-2-[8-(2-methyl-1-oxo-2-prop-2-enylpent-4-enoxy)-8,8a-dihydronaphthalen-1-yl]heptanoic acid IUPAC Name: 3,5-dihydroxy-2-methyl-2-[8-(2-methyl-2-prop-2-enylpent-4-enoyl)oxy-8,8a-dihydronaphthalen-1-yl]heptanoic acid Traditional Name: 2-[8-(2-allyl-2-methyl-pent-4-enoyl)oxy-8,8a-dihydronaphthalen-1-yl]-3,5-dihydroxy-2-methyl-enanthic acid Formula: C27H36O6 MolecularWeight: 456.57114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(C)(C1=CC=CC2=CC=CC(C21)OC(=O)C(C)(CC=C)CC=C)C(=O)O)O)O

Isomeric SMILES

CCC(CC(C(C)(C1=CC=CC2=CC=CC(C21)OC(=O)C(C)(CC=C)CC=C)C(=O)O)O)O

InChI

InChI=1S/C27H36O6/c1-6-15-26(4,16-7-2)25(32)33-21-14-10-12-18-11-9-13-20(23(18)21)27(5,24(30)31)22(29)17-19(28)8-3/h6-7,9-14,19,21-23,28-29H,1-2,8,15-17H2,3-5H3,(H,30,31)