Vitas-M small molecule compound
(3-nitrophenyl)[(1S,2R,3S,3aR)-2-phenyl-3-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]methanone
Catalog ID
STK553711
SMILES O=C([C@@H]1[C@@H](c2ccccc2)[C@@H]([C@@H]2N1c1ccccc1C=C2)C(=O)c1ccccc1)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 C32H24N2O4 MW 500.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24N2O4/c35-31(23-13-5-2-6-14-23)29-27-19-18-21-10-7-8-17-26(21)33(27)30(28(29)22-11-3-1-4-12-22)32(36)24-15-9-16-25(20-24)34(37)38/h1-20,27-30H/t27-,28+,29-,30+/m1/s1InChIKey
NMHDINZUWSXCHF-ATIZSFMBSA-NSynonyms
1013784-80-9((1S2R3S3aR)1(3nitrobenzoyl)2phenyl1233atetrahydropyrrolo(12a)quinolin3yl)phenylmethanone
((1S2R3S3aR)3benzoyl2phenyl1233atetrahydropyrrolo(12a)quinolin1yl)(3nitrophenyl)methanone
(3nitrophenyl)((1S2R3S3aR)2phenyl3(phenylcarbonyl)1233atetrahydropyrrolo(12a)quinolin1yl)methanone
1013784809
C1=CC=C(C=C1)C2C(C3C=CC4=CC=CC=C4N3C2C(=O)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C6=CC=CC=C6
InChI=1SC32H24N2O4c3531(23135261423)292719182110781726(21)33(27)30(28(29)22113141222)32(36)241591625(2024)34(37)38h1202730Ht2728+2930+m1s1
MFCD18242738
O=C((C@@H)1(C@@H)(c2ccccc2)(C@@H)((C@@H)2N1c1ccccc1C=C2)C(=O)c1ccccc1)c1cccc(c1)(N+)(=O)(O)
ZINC000101024778
ZINC101024778
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.