[(2S,3R,4R,5S,6S)-6-methoxy-2-methyl-4-phenoxycarbothioyloxy-5-phenylmethoxy-oxan-3-yl] benzoate

Systemtic Name: [(2S,3R,4R,5S,6S)-6-methoxy-2-methyl-4-phenoxycarbothioyloxy-5-phenylmethoxy-oxan-3-yl] benzoate Openeye Name: [(2S,3R,4R,5S,6S)-5-benzyloxy-6-methoxy-2-methyl-4-phenoxycarbothioyloxy-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3R,4R,5S,6S)-6-methoxy-2-methyl-4-[phenoxy(sulfanylidene)methoxy]-5-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3R,4R,5S,6S)-6-methoxy-2-methyl-4-phenoxycarbothioyloxy-5-phenylmethoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3R,4R,5S,6S)-5-benzoxy-6-methoxy-2-methyl-4-phenoxycarbothioyloxy-tetrahydropyran-3-yl] ester Formula: C28H28O7S MolecularWeight: 508.58272

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC)OCC2=CC=CC=C2)OC(=S)OC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)OC)OCC2=CC=CC=C2)OC(=S)OC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H28O7S/c1-19-23(34-26(29)21-14-8-4-9-15-21)24(35-28(36)33-22-16-10-5-11-17-22)25(27(30-2)32-19)31-18-20-12-6-3-7-13-20/h3-17,19,23-25,27H,18H2,1-2H3/t19-,23+,24+,25-,27-/m0/s1