Vitas-M small molecule compound
3-(methoxycarbonyl)-1-methyl-6-nitro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
Catalog ID
STK605840
SMILES COC(=O)C1(CN(C)c2c(C1)cc(cc2)[N+](=O)[O-])C(=O)O
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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 C13H14N2O6 MW 294.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O6/c1-14-7-13(11(16)17,12(18)21-2)6-8-5-9(15(19)20)3-4-10(8)14/h3-5H,6-7H2,1-2H3,(H,16,17)InChIKey
MZYBCZIWTQOOBV-UHFFFAOYSA-NSynonyms
919730-00-03(methoxycarbonyl)1methyl6nitro1234tetrahydroquinoline3carboxylicacid
3methoxycarbonyl1methyl6nitro24dihydroquinoline3carboxylicacid
919730000
CN1CC(CC2=C1C=CC(=C2)(N+)(=O)(O))(C(=O)O)C(=O)OC
COC(=O)C1(CN(C)c2c(C1)cc(cc2)(N+)(=O)(O))C(=O)O
InChI=1SC13H14N2O6c114713(11(16)1712(18)212)6859(15(19)20)3410(8)14h35H67H212H3(H1617)
MFCD08748927
ZINC000009344273
ZINC000009344274
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