[(3S,4S)-2-iodanyl-4-(methoxymethoxy)-6-methyl-hept-1-en-3-yl] benzoate

Systemtic Name: [(3S,4S)-2-iodanyl-4-(methoxymethoxy)-6-methyl-hept-1-en-3-yl] benzoate Openeye Name: [(1S,2S)-1-(1-iodovinyl)-2-(methoxymethoxy)-4-methyl-pentyl] benzoate CAS Name: benzoic acid [(3S,4S)-2-iodo-4-(methoxymethoxy)-6-methylhept-1-en-3-yl] ester IUPAC Name: [(3S,4S)-2-iodo-4-(methoxymethoxy)-6-methylhept-1-en-3-yl] benzoate Traditional Name: benzoic acid [(1S)-2-iodo-1-[(1S)-1-(methoxymethoxy)-3-methyl-butyl]allyl] ester Formula: C17H23IO4 MolecularWeight: 418.26659

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=C)I)OC(=O)C1=CC=CC=C1)OCOC

Isomeric SMILES

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

InChI

InChI=1S/C17H23IO4/c1-12(2)10-15(21-11-20-4)16(13(3)18)22-17(19)14-8-6-5-7-9-14/h5-9,12,15-16H,3,10-11H2,1-2,4H3/t15-,16+/m0/s1