Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-3-chloronaphthalene-1,4-dione
Catalog ID
STK536657
SMILES ClC1=C(NCc2ccc3c(c2)OCO3)C(=O)c2c(C1=O)cccc2
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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 C18H12ClNO4 MW 341.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClNO4/c19-15-16(18(22)12-4-2-1-3-11(12)17(15)21)20-8-10-5-6-13-14(7-10)24-9-23-13/h1-7,20H,8-9H2InChIKey
XEEFISACIKFQMX-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)amino)3chloronaphthalene14dione
2((benzo(d)(13)dioxol5ylmethyl)amino)3chloronaphthalene14dione
2(13BENZODIOXOL5YLMETHYLAMINO)3CHLORONAPHTHALENE14DIONE
C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=O)C4=CC=CC=C4C3=O)Cl
InChI=1SC18H12ClNO4c191516(18(22)12421311(12)17(15)21)20810561314(710)2492313h1720H89H2
MFCD02989441
ZINC000100768981
ZINC100768981
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