methyl (2S)-2-[(2S)-2-methyl-1-oxidanyl-but-3-en-2-yl]-3-oxidanylidene-5-phenyl-furan-2-carboxylate

Systemtic Name: methyl (2S)-2-[(2S)-2-methyl-1-oxidanyl-but-3-en-2-yl]-3-oxidanylidene-5-phenyl-furan-2-carboxylate Openeye Name: methyl (2S)-2-[(1S)-1-(hydroxymethyl)-1-methyl-allyl]-3-oxo-5-phenyl-furan-2-carboxylate CAS Name: (2S)-2-[(2S)-1-hydroxy-2-methylbut-3-en-2-yl]-3-oxo-5-phenyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl (2S)-2-[(2S)-1-hydroxy-2-methylbut-3-en-2-yl]-3-oxo-5-phenylfuran-2-carboxylate Traditional Name: (2S)-3-keto-2-[(1S)-1-methyl-1-methylol-allyl]-5-phenyl-furan-2-carboxylic acid methyl ester Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C=C)C1(C(=O)C=C(O1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

C[C@@](CO)(C=C)[C@]1(C(=O)C=C(O1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H18O5/c1-4-16(2,11-18)17(15(20)21-3)14(19)10-13(22-17)12-8-6-5-7-9-12/h4-10,18H,1,11H2,2-3H3/t16-,17-/m0/s1