Vitas-M small molecule compound
3-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]-5-oxopentanoic acid
Catalog ID
STK465036
SMILES OC(=O)CC(CC(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])C
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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 C16H21N3O5 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O5/c1-12(11-16(21)22)10-15(20)18-8-6-17(7-9-18)13-2-4-14(5-3-13)19(23)24/h2-5,12H,6-11H2,1H3,(H,21,22)InChIKey
WWUFESNLDATWJB-UHFFFAOYSA-NSynonyms
3methyl5(4(4nitrophenyl)piperazin1yl)5oxopentanoicacid
3METHYL5(4(4NITROPHENYL)PIPERAZINYL)5OXOPENTANOICACID
CC(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)(N+)(=O)(O))CC(=O)O
InChI=1SC16H21N3O5c112(1116(21)22)1015(20)188617(7918)132414(5313)19(23)24h2512H611H21H3(H2122)
MFCD06065934
OC(=O)CC(CC(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))C
ZINC000017070589
ZINC000017070590
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