AC1O79W7

(2S,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(2,3,4-trimethoxyphenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile

Also Known As: (2S,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(2,3,4-trimethoxyphenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile|(2S,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(2,3,4-trimethoxyphenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile|(2S,3R,10bS)-3-pivaloyl-2-(2,3,4-trimethoxyphenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile|(9S,10aS,8R)-8-(2,2-dimethylpropanoyl)-9-(2,3,4-trimethoxyphenyl)-7,10a-dihydr opyrrolidino[2,1-a]isoquinoline-10,10-dicarbonitrile

Molecular Formula	C28H29N3O4
Molecular Weight	471.21582 g/mol
LogP	4.85456
Topological Polar Surface Area	95.58 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	471.21582
Monoisotopic Mass	471.21582
Heavy Atoms	35
Complexity	1264.5734

Chemical Identifiers

CAS Number	956987-79-4
SMILES	CC(C)(C)C(=O)[C@H]1[C@@H](C([C@H]2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=C(C(=C(C=C4)OC)OC)OC