methyl (E,4R,5S)-5-[(3S)-3-oxidanylbutanoyl]oxy-4-phenylmethoxy-hex-2-enoate

Systemtic Name: methyl (E,4R,5S)-5-[(3S)-3-oxidanylbutanoyl]oxy-4-phenylmethoxy-hex-2-enoate Openeye Name: methyl (E,4R,5S)-4-benzyloxy-5-[(3S)-3-hydroxybutanoyl]oxy-hex-2-enoate CAS Name: (E,4R,5S)-5-[(3S)-3-hydroxy-1-oxobutoxy]-4-phenylmethoxy-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4R,5S)-5-[(3S)-3-hydroxybutanoyl]oxy-4-phenylmethoxyhex-2-enoate Traditional Name: (E,4R,5S)-4-benzoxy-5-[(3S)-3-hydroxybutanoyl]oxy-hex-2-enoic acid methyl ester Formula: C18H24O6 MolecularWeight: 336.37956

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(C=CC(=O)OC)OCC1=CC=CC=C1)O

Isomeric SMILES

C[C@@H](CC(=O)O[C@@H](C)[C@@H](/C=C/C(=O)OC)OCC1=CC=CC=C1)O

InChI

InChI=1S/C18H24O6/c1-13(19)11-18(21)24-14(2)16(9-10-17(20)22-3)23-12-15-7-5-4-6-8-15/h4-10,13-14,16,19H,11-12H2,1-3H3/b10-9+/t13-,14-,16+/m0/s1