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(3a'R,8b'S)-5-chloro-2'-[2-(3,4-dimethoxyphenyl)ethyl]-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione

Catalog ID
STK575395
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(N4C3CCC4)C(=O)Nc3c2cc(Cl)cc3)ccc1OC

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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 C26H26ClN3O5 MW 495.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O5/c1-34-19-8-5-14(12-20(19)35-2)9-11-29-23(31)21-18-4-3-10-30(18)26(22(21)24(29)32)16-13-15(27)6-7-17(16)28-25(26)33/h5-8,12-13,18,21-22H,3-4,9-11H2,1-2H3,(H,28,33)/t18?,21-,22+,26?/m1/s1
InChIKey
KBMFWHVXHYDCLZ-OJXBHUFOSA-N
Synonyms
1014022-98-0
(3aR8bS)5chloro2(2(34dimethoxyphenyl)ethyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3aR8bS)5chloro2(2(34dimethoxyphenyl)ethyl)spiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
(3aR8bS)5chloro2(34dimethoxyphenethyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
1014022980
COC1=C(C=C(C=C1)CCN2C(=O)C3C4CCCN4C5(C3C2=O)C6=C(C=CC(=C6)Cl)NC5=O)OC
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(N4C3CCC4)C(=O)Nc3c2cc(Cl)cc3)ccc1OC
InChI=1SC26H26ClN3O5c134198514(1220(19)352)9112923(31)2118431030(18)26(22(21)24(29)32)161315(27)6717(16)2825(26)33h581213182122H34911H212H3(H2833)t18?2122+26?m1s1
MFCD06790569
ZINC000016024671
ZINC000227041194

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Available files

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