Vitas-M small molecule compound
methyl 3-[(3-butoxypropyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK037196
SMILES CCCCOCCCNC(=O)c1cc(cc(c1)C(=O)OC)[N+](=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 C16H22N2O6 MW 338.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O6/c1-3-4-7-24-8-5-6-17-15(19)12-9-13(16(20)23-2)11-14(10-12)18(21)22/h9-11H,3-8H2,1-2H3,(H,17,19)InChIKey
KFLMDPHNZKOIMA-UHFFFAOYSA-NSynonyms
431994-00-2431994002
CCCCOCCCNC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC
CCCCOCCCNC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
InChI=1SC16H22N2O6c1347248561715(19)12913(16(20)232)1114(1012)18(21)22h911H38H212H3(H1719)
METHYL3((3BUTOXYPROPYL)CARBAMOYL)5NITROBENZOATE
METHYL3(3BUTOXYPROPYLCARBAMOYL)5NITROBENZOATE
MFCD03143296
STK037196
ZINC000002988272
ZINC02988272
ZINC2988272
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