Vitas-M small molecule compound
methyl 3-[(1-methoxypropan-2-yl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK046557
SMILES COCC(NC(=O)c1cc(cc(c1)C(=O)OC)[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 C13H16N2O6 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O6/c1-8(7-20-2)14-12(16)9-4-10(13(17)21-3)6-11(5-9)15(18)19/h4-6,8H,7H2,1-3H3,(H,14,16)InChIKey
VRNCNFCVIZBIDN-UHFFFAOYSA-NSynonyms
349439-87-8349439878
CC(COC)NC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC
COCC(NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O))C
InChI=1SC13H16N2O6c18(7202)1412(16)9410(13(17)213)611(59)15(18)19h468H7H213H3(H1416)
METHYL3((1METHOXYPROPAN2YL)CARBAMOYL)5NITROBENZOATE
METHYL3(1METHOXYPROPAN2YLCARBAMOYL)5NITROBENZOATE
METHYL5(N(2METHOXYISOPROPYL)CARBAMOYL)3NITROBENZOATE
MFCD02603885
STK046557
ZINC000000455591
ZINC000000455592
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