Vitas-M small molecule compound
methyl 3-(1,3-benzodioxol-5-ylcarbamoyl)-5-nitrobenzoate
Catalog ID
STK323225
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccc2c(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 C16H12N2O7 MW 344.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O7/c1-23-16(20)10-4-9(5-12(6-10)18(21)22)15(19)17-11-2-3-13-14(7-11)25-8-24-13/h2-7H,8H2,1H3,(H,17,19)InChIKey
UQCSPRGKATWWLV-UHFFFAOYSA-NSynonyms
708221-87-8708221878
COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCO3)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ccc2c(c1)OCO2
InChI=1SC16H12N2O7c12316(20)1049(512(610)18(21)22)15(19)1711231314(711)2582413h27H8H21H3(H1719)
methyl3(13benzodioxol5ylcarbamoyl)5nitrobenzoate
METHYL5(N(2HBENZO(34D)13DIOXOLEN5YL)CARBAMOYL)3NITROBENZOATE
MFCD04277974
ZINC000002857200
ZINC02857200
ZINC2857200
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Check stock on Vitas-MAvailable files
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