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Substance Name: Benzamide, 4-cyano-N-((5S,5aS,8aR,9R)-5,5a,6,8,8a,9-hexahydro-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxofuro(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-5-yl)-
RN: 117507-78-5
InChIKey: LZPJPJMBGOLYGX-QNMIOERPSA-N

Molecular Formula

  • C29-H24-N2-O8

Molecular Weight

  • 528.5146
 
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Names and Synonyms

  • Benzamide, 4-cyano-N-((5S,5aS,8aR,9R)-5,5a,6,8,8a,9-hexahydro-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxofuro(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-5-yl)-

Registry Numbers

CAS Registry Number

  • 117507-78-5

System Generated Number

  • 0117507785

Structure Descriptors

InChI

1S/C29H24N2O8/c1-35-22-7-16(8-23(36-2)27(22)32)24-17-9-20-21(39-13-38-20)10-18(17)26(19-12-37-29(34)25(19)24)31-28(33)15-5-3-14(11-30)4-6-15/h3-10,19,24-26,32H,12-13H2,1-2H3,(H,31,33)/t19-,24+,25-,26+/m0/s1

InChIKey

LZPJPJMBGOLYGX-QNMIOERPSA-N

Smiles

COc1cc(cc(c1O)OC)[C@@H]2c3cc4c(cc3[C@H]([C@@H]5[C@@H]2C(=O)OC5)NC(=O)c6ccc(cc6)C#N)OCO4