(E,8R,9S,10S)-8,10-dimethyl-9-oxidanyl-1,11-bis(phenylmethoxy)undec-6-en-5-one

Systemtic Name: (E,8R,9S,10S)-8,10-dimethyl-9-oxidanyl-1,11-bis(phenylmethoxy)undec-6-en-5-one Openeye Name: (E,8R,9S,10S)-1,11-dibenzyloxy-9-hydroxy-8,10-dimethyl-undec-6-en-5-one CAS Name: (E,8R,9S,10S)-9-hydroxy-8,10-dimethyl-1,11-bis(phenylmethoxy)-6-undecen-5-one IUPAC Name: (E,8R,9S,10S)-9-hydroxy-8,10-dimethyl-1,11-bis(phenylmethoxy)undec-6-en-5-one Traditional Name: (E,8R,9S,10S)-1,11-dibenzoxy-9-hydroxy-8,10-dimethyl-undec-6-en-5-one Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)C(C(C)C=CC(=O)CCCCOCC2=CC=CC=C2)O

Isomeric SMILES

C[C@@H](COCC1=CC=CC=C1)[C@H]([C@H](C)/C=C/C(=O)CCCCOCC2=CC=CC=C2)O

InChI

InChI=1S/C27H36O4/c1-22(27(29)23(2)19-31-21-25-13-7-4-8-14-25)16-17-26(28)15-9-10-18-30-20-24-11-5-3-6-12-24/h3-8,11-14,16-17,22-23,27,29H,9-10,15,18-21H2,1-2H3/b17-16+/t22-,23+,27+/m1/s1