[(7R,8R)-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S,3R)-4-(1,3-dithian-2-ylidene)-2-[(4-methoxyphenyl)methoxy]-2,3-dimethyl-butanoate

Systemtic Name: [(7R,8R)-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S,3R)-4-(1,3-dithian-2-ylidene)-2-[(4-methoxyphenyl)methoxy]-2,3-dimethyl-butanoate Openeye Name: [(7R,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S,3R)-4-(1,3-dithian-2-ylidene)-2-[(4-methoxyphenyl)methoxy]-2,3-dimethyl-butanoate CAS Name: (2S,3R)-4-(1,3-dithian-2-ylidene)-2-[(4-methoxyphenyl)methoxy]-2,3-dimethylbutanoic acid [(7R,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl ester IUPAC Name: [(7R,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S,3R)-4-(1,3-dithian-2-ylidene)-2-[(4-methoxyphenyl)methoxy]-2,3-dimethylbutanoate Traditional Name: (2S,3R)-4-(1,3-dithian-2-ylidene)-2,3-dimethyl-2-p-anisyloxy-butyric acid [(7R,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl ester Formula: C26H35NO5S2 MolecularWeight: 505.6898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C1SCCCS1)C(C)(C(=O)OCC2=CCN3C2C(CC3)O)OCC4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C=C1SCCCS1)[C@@](C)(C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)O)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H35NO5S2/c1-18(15-23-33-13-4-14-34-23)26(2,32-16-19-5-7-21(30-3)8-6-19)25(29)31-17-20-9-11-27-12-10-22(28)24(20)27/h5-9,15,18,22,24,28H,4,10-14,16-17H2,1-3H3/t18-,22-,24-,26+/m1/s1