[(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethyl-octa-2,6-dienyl] benzenesulfinate

Systemtic Name: [(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethyl-octa-2,6-dienyl] benzenesulfinate Openeye Name: [(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethyl-octa-2,6-dienyl] benzenesulfinate CAS Name: benzenesulfinic acid [(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethylocta-2,6-dienyl] ester IUPAC Name: [(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethylocta-2,6-dienyl] benzenesulfinate Traditional Name: benzenesulfinic acid [(2Z,4R,5R,6E)-5-methoxy-2,4,6-trimethyl-octa-2,6-dienyl] ester Formula: C18H26O3S MolecularWeight: 322.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(C(C)C=C(C)COS(=O)C1=CC=CC=C1)OC

Isomeric SMILES

C/C=C(\C)/[C@@H]([C@H](C)/C=C(/C)\COS(=O)C1=CC=CC=C1)OC

InChI

InChI=1S/C18H26O3S/c1-6-15(3)18(20-5)16(4)12-14(2)13-21-22(19)17-10-8-7-9-11-17/h6-12,16,18H,13H2,1-5H3/b14-12-,15-6+/t16-,18+,22?/m1/s1