methyl (E)-4-methoxy-4-[(2R,3R,4S)-4-oxidanyl-3-phenylmethoxy-thiolan-2-yl]but-2-enoate

Systemtic Name: methyl (E)-4-methoxy-4-[(2R,3R,4S)-4-oxidanyl-3-phenylmethoxy-thiolan-2-yl]but-2-enoate Openeye Name: methyl (E)-4-[(2R,3R,4S)-3-benzyloxy-4-hydroxy-tetrahydrothiophen-2-yl]-4-methoxy-but-2-enoate CAS Name: (E)-4-[(2R,3R,4S)-4-hydroxy-3-phenylmethoxy-2-thiolanyl]-4-methoxy-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[(2R,3R,4S)-4-hydroxy-3-phenylmethoxythiolan-2-yl]-4-methoxybut-2-enoate Traditional Name: (E)-4-[(2R,3R,4S)-3-benzoxy-4-hydroxy-tetrahydrothiophen-2-yl]-4-methoxy-but-2-enoic acid methyl ester Formula: C17H22O5S MolecularWeight: 338.41858

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Descriptors Computed from Structure

Canonical SMILES:

COC(C=CC(=O)OC)C1C(C(CS1)O)OCC2=CC=CC=C2

Isomeric SMILES

COC(/C=C/C(=O)OC)[C@@H]1[C@@H]([C@@H](CS1)O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22O5S/c1-20-14(8-9-15(19)21-2)17-16(13(18)11-23-17)22-10-12-6-4-3-5-7-12/h3-9,13-14,16-18H,10-11H2,1-2H3/b9-8+/t13-,14?,16-,17-/m1/s1