Vitas-M small molecule compound

3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-N-(4-methyl-3-nitrophenyl)propanamide

Catalog ID
STK258510
SMILES O=C(Nc1ccc(c(c1)[N+](=O)[O-])C)CCN1C(=O)C2C(C1=O)C1CC2CC1

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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 C19H21N3O5 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O5/c1-10-2-5-13(9-14(10)22(26)27)20-15(23)6-7-21-18(24)16-11-3-4-12(8-11)17(16)19(21)25/h2,5,9,11-12,16-17H,3-4,6-8H2,1H3,(H,20,23)
InChIKey
JJDXFQYTEGVSCN-UHFFFAOYSA-N
Synonyms

3(13dioxooctahydro2H47methanoisoindol2yl)N(4methyl3nitrophenyl)propanamide
CC1=C(C=C(C=C1)NC(=O)CCN2C(=O)C3C4CCC(C4)C3C2=O)(N+)(=O)(O)
InChI=1SC19H21N3O5c1102513(914(10)22(26)27)2015(23)672118(24)16113412(811)17(16)19(21)25h25911121617H3468H21H3(H2023)
MFCD03185685
O=C(Nc1ccc(c(c1)(N+)(=O)(O))C)CCN1C(=O)C2C(C1=O)C1CC2CC1
ZINC000101322442
ZINC000101696416

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Available files

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