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(3aR,4S,9aR,9bS)-4-[(4-bromophenyl)carbonyl]-2-(2-methyl-4-nitrophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione

Catalog ID
STK542085
SMILES Brc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)c1ccccc1

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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 C31H22BrN3O6 MW 612.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22BrN3O6/c1-17-15-22(35(40)41)11-12-23(17)34-30(38)25-24-16-20(28(36)18-5-3-2-4-6-18)13-14-33(24)27(26(25)31(34)39)29(37)19-7-9-21(32)10-8-19/h2-16,24-27H,1H3/t24-,25-,26-,27+/m1/s1
InChIKey
MTTQTMDNVSINLG-CWTOASCOSA-N
Synonyms

(3aR4S9aR9bS)4((4bromophenyl)carbonyl)2(2methyl4nitrophenyl)8(phenylcarbonyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(4bromobenzoyl)2(2methyl4nitrophenyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(4bromobenzoyl)2(2methyl4nitrophenyl)3a49a9btetrahydropyrrolo(34a)indolizine13dione
Brc1ccc(cc1)C(=O)(C@H)1N2C=CC(=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1C)(N+)(=O)(O))C(=O)c1ccccc1
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4C=C(C=CN4C(C3C2=O)C(=O)C5=CC=C(C=C5)Br)C(=O)C6=CC=CC=C6
InChI=1SC31H22BrN3O6c1171522(35(40)41)111223(17)3430(38)25241620(28(36)185324618)131433(24)27(26(25)31(34)39)29(37)197921(32)10819h2162427H1H3t24252627+m1s1
MFCD18241962
ZINC000101064554
ZINC101064554

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Available files

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