Vitas-M small molecule compound
4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxobutanoic acid
Catalog ID
STK792548
SMILES OC(=O)CCC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C16H20N2O5 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O5/c19-15(3-4-16(20)21)18-7-5-17(6-8-18)10-12-1-2-13-14(9-12)23-11-22-13/h1-2,9H,3-8,10-11H2,(H,20,21)InChIKey
HEXADDRAWPRQIP-UHFFFAOYSA-NSynonyms
620931-01-34(4(13benzodioxol5ylmethyl)piperazin1yl)4oxobutanoicacid
4(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN4IUM1YL)4OXOBUTANOATE
4(4(2H13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)4OXOBUTANOICACID
4(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)4OXOBUTANOICACID
4(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)4oxobutanoicacid
4(4BENZO(13)DIOXOL5YLMETHYLPIPERAZIN1YL)4OXOBUTYRICACID
620931013
C1CN(CC(NH+)1CC2=CC3=C(C=C2)OCO3)C(=O)CCC(=O)(O)
InChI=1SC16H20N2O5c1915(3416(20)21)187517(6818)1012121314(912)23112213h129H381011H2(H2021)
MFCD06010508
ZINC000004501910
ZINC04501910
ZINC4501910
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