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(3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)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
STK548676
SMILES COc1ccc(cc1Br)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 C32H24BrN3O7 MW 642.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24BrN3O7/c1-17-14-21(36(41)42)9-10-23(17)35-31(39)26-24-16-20(29(37)18-6-4-3-5-7-18)12-13-34(24)28(27(26)32(35)40)30(38)19-8-11-25(43-2)22(33)15-19/h3-16,24,26-28H,1-2H3/t24-,26-,27-,28+/m1/s1
InChIKey
WAUYJCKSLLJLNR-SATIQFTFSA-N
Synonyms

(3aR4S9aR9bS)4((3bromo4methoxyphenyl)carbonyl)2(2methyl4nitrophenyl)8(phenylcarbonyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(3bromo4methoxybenzoyl)2(2methyl4nitrophenyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(3bromo4methoxybenzoyl)2(2methyl4nitrophenyl)3a49a9btetrahydropyrrolo(34a)indolizine13dione
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4C=C(C=CN4C(C3C2=O)C(=O)C5=CC(=C(C=C5)OC)Br)C(=O)C6=CC=CC=C6
COc1ccc(cc1Br)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
InChI=1SC32H24BrN3O7c1171421(36(41)42)91023(17)3531(39)26241620(29(37)186435718)121334(24)28(27(26)32(35)40)30(38)1981125(432)22(33)1519h316242628H12H3t24262728+m1s1
MFCD18242433
ZINC000150431988
ZINC150431988

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Available files

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