ethyl 5-[(1S,2S)-1-(dioxidanyl)-2-phenylmethoxy-propyl]-2-methyl-furan-3-carboxylate

Systemtic Name: ethyl 5-[(1S,2S)-1-(dioxidanyl)-2-phenylmethoxy-propyl]-2-methyl-furan-3-carboxylate Openeye Name: ethyl 5-[(1S,2S)-2-benzyloxy-1-hydroperoxy-propyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(1S,2S)-1-hydroperoxy-2-phenylmethoxypropyl]-2-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(1S,2S)-1-hydroperoxy-2-phenylmethoxypropyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(1S,2S)-2-benzoxy-1-hydroperoxy-propyl]-2-methyl-furan-3-carboxylic acid ethyl ester Formula: C18H22O6 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1)C(C(C)OCC2=CC=CC=C2)OO)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1)[C@H]([C@H](C)OCC2=CC=CC=C2)OO)C

InChI

InChI=1S/C18H22O6/c1-4-21-18(19)15-10-16(23-12(15)2)17(24-20)13(3)22-11-14-8-6-5-7-9-14/h5-10,13,17,20H,4,11H2,1-3H3/t13-,17-/m0/s1