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(1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-[(3-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK550995
SMILES O=C([C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)c1cccc(c1)[N+](=O)[O-]

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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 C31H27N3O5 MW 521.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O5/c1-30(2,3)28(36)26-25(27(35)19-10-8-11-20(17-19)34(38)39)31(21-12-5-6-13-22(21)32-29(31)37)24-16-15-18-9-4-7-14-23(18)33(24)26/h4-17,24-26H,1-3H3,(H,32,37)/t24-,25+,26+,31-/m1/s1
InChIKey
JWJMOAGUGRHVMR-SQRAXXTESA-N
Synonyms
1214632-44-6
(1S2S3R3aR)1(22dimethylpropanoyl)2((3nitrophenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)1(22dimethylpropanoyl)2(3nitrobenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)2(3nitrobenzoyl)1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1214632446
CC(C)(C)C(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C5=CC=CC=C5NC2=O)C(=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC31H27N3O5c130(23)28(36)2625(27(35)191081120(1719)34(38)39)31(2112561322(21)3229(31)37)241615189471423(18)33(24)26h4172426H13H3(H3237)t2425+26+31m1s1
MFCD18242554
O=C((C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)c1cccc(c1)(N+)(=O)(O)
ZINC000009009576
ZINC09009576
ZINC9009576

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Available files

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