2-methylpropyl 2,4-bis(oxidanyl)-6-[(6R)-6-oxidanylheptyl]benzoate

Systemtic Name: 2-methylpropyl 2,4-bis(oxidanyl)-6-[(6R)-6-oxidanylheptyl]benzoate Openeye Name: isobutyl 2,4-dihydroxy-6-[(6R)-6-hydroxyheptyl]benzoate CAS Name: 2,4-dihydroxy-6-[(6R)-6-hydroxyheptyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2,4-dihydroxy-6-[(6R)-6-hydroxyheptyl]benzoate Traditional Name: 2,4-dihydroxy-6-[(6R)-6-hydroxyheptyl]benzoic acid isobutyl ester Formula: C18H28O5 MolecularWeight: 324.41192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(C=C(C=C1CCCCCC(C)O)O)O

Isomeric SMILES

C[C@H](CCCCCC1=CC(=CC(=C1C(=O)OCC(C)C)O)O)O

InChI

InChI=1S/C18H28O5/c1-12(2)11-23-18(22)17-14(9-15(20)10-16(17)21)8-6-4-5-7-13(3)19/h9-10,12-13,19-21H,4-8,11H2,1-3H3/t13-/m1/s1