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(3aS,4R,9aS,9bR)-2-(2,4-dichlorophenyl)-4-[(3-nitrophenyl)carbonyl]-1,3-dioxo-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile

Catalog ID
STK554168
SMILES N#CC1=C[C@@H]2N(C=C1)[C@H]([C@@H]1[C@H]2C(=O)N(C1=O)c1ccc(cc1Cl)Cl)C(=O)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 C24H14Cl2N4O5 MW 509.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14Cl2N4O5/c25-14-4-5-17(16(26)10-14)29-23(32)19-18-8-12(11-27)6-7-28(18)21(20(19)24(29)33)22(31)13-2-1-3-15(9-13)30(34)35/h1-10,18-21H/t18-,19-,20-,21+/m0/s1
InChIKey
ATROIBWZBQQATE-XSDIEEQYSA-N
Synonyms
1014083-19-2
(3aS4R9aS9bR)2(24dichlorophenyl)4((3nitrophenyl)carbonyl)13dioxo233a49a9bhexahydro1Hpyrrolo(34a)indolizine8carbonitrile
(3aS4R9aS9bR)2(24dichlorophenyl)4(3nitrobenzoyl)13dioxo233a49a9bhexahydro1Hpyrrolo(34a)indolizine8carbonitrile
(3aS4R9aS9bR)2(24dichlorophenyl)4(3nitrobenzoyl)13dioxo3a49a9btetrahydropyrrolo(34a)indolizine8carbonitrile
1014083192
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)C2C3C(C4N2C=CC(=C4)C#N)C(=O)N(C3=O)C5=C(C=C(C=C5)Cl)Cl
InChI=1SC24H14Cl2N4O5c25144517(16(26)1014)2923(32)1918812(1127)6728(18)21(20(19)24(29)33)22(31)1321315(913)30(34)35h1101821Ht18192021+m0s1
MFCD18242778
N#CC1=C(C@@H)2N(C=C1)(C@H)((C@@H)1(C@H)2C(=O)N(C1=O)c1ccc(cc1Cl)Cl)C(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000016039169
ZINC16039169

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Available files

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