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(2R,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile

Catalog ID
STK755353
SMILES N#CC1(C#N)[C@@H](c2cc(OC)c(c(c2)OC)OC)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C(C)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C28H29N3O4 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4/c1-27(2,3)26(32)23-22(18-13-20(33-4)24(35-6)21(14-18)34-5)28(15-29,16-30)25-19-10-8-7-9-17(19)11-12-31(23)25/h7-14,22-23,25H,1-6H3/t22-,23+,25-/m0/s1
InChIKey
NJKVAFLMZSCYOK-ARNLJNQMSA-N
Synonyms
293313-09-4
(2R3R10bS)3(22dimethylpropanoyl)2(345trimethoxyphenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10BS)3(22DIMETHYLPROPANOYL)2(345TRIMETHOXYPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
(2R3R10bS)3pivaloyl2(345trimethoxyphenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
293313094
3(22DIMETHYLPROPANOYL)2(345TRIMETHOXYPHENYL)23DIHYDROPYRROLO(21A)ISOQUINOLINE11(10BH)DICARBONITRILE
CC(C)(C)C(=O)C1C(C(C2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=CC(=C(C(=C4)OC)OC)OC
InChI=1SC28H29N3O4c127(23)26(32)2322(181320(334)24(356)21(1418)345)28(15291630)25191087917(19)111231(23)25h714222325H16H3t2223+25m0s1
MFCD01244713
N#CC1(C#N)(C@@H)(c2cc(OC)c(c(c2)OC)OC)(C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)C(C)(C)C
ZINC000035366008
ZINC35366008

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Available files

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