(2,6-dimethylphenyl) (2R,3S,6S)-2,6-dimethyl-3-oxidanyl-oct-7-enoate

Systemtic Name: (2,6-dimethylphenyl) (2R,3S,6S)-2,6-dimethyl-3-oxidanyl-oct-7-enoate Openeye Name: (2,6-dimethylphenyl) (2R,3S,6S)-3-hydroxy-2,6-dimethyl-oct-7-enoate CAS Name: (2R,3S,6S)-3-hydroxy-2,6-dimethyl-7-octenoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (2R,3S,6S)-3-hydroxy-2,6-dimethyloct-7-enoate Traditional Name: (2R,3S,6S)-3-hydroxy-2,6-dimethyl-oct-7-enoic acid (2,6-dimethylphenyl) ester Formula: C18H26O3 MolecularWeight: 290.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C(C)C(CCC(C)C=C)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)[C@H](C)[C@H](CC[C@H](C)C=C)O

InChI

InChI=1S/C18H26O3/c1-6-12(2)10-11-16(19)15(5)18(20)21-17-13(3)8-7-9-14(17)4/h6-9,12,15-16,19H,1,10-11H2,2-5H3/t12-,15-,16+/m1/s1