Vitas-M small molecule compound
N-(3-methylpent-1-yn-3-yl)-6-nitro-2-oxo-2H-chromene-3-carboxamide
Catalog ID
STK769997
SMILES CCC(NC(=O)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])(C#C)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 C16H14N2O5 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5/c1-4-16(3,5-2)17-14(19)12-9-10-8-11(18(21)22)6-7-13(10)23-15(12)20/h1,6-9H,5H2,2-3H3,(H,17,19)InChIKey
OYPFFIYEIIQZGT-UHFFFAOYSA-NSynonyms
2HCHROMENE3CARBOXYLICACID6NITRO2OXO(1ETHYL1METHYLPROP2YNYL)AMIDE
CCC(C)(C#C)NC(=O)C1=CC2=C(C=CC(=C2)(N+)(=O)(O))OC1=O
CCC(NC(=O)c1cc2cc(ccc2oc1=O)(N+)(=O)(O))(C#C)C
InChI=1SC16H14N2O5c1416(352)1714(19)12910811(18(21)22)6713(10)2315(12)20h169H5H223H3(H1719)
MFCD03763934
N(1ETHYL1METHYLPROP2YN1YL)6NITRO2OXO2HCHROMENE3CARBOXAMIDE
N(1ETHYL1METHYLPROP2YNYL)(6NITRO2OXOCHROMEN3YL)CARBOXAMIDE
N(3methylpent1yn3yl)6nitro2oxo2Hchromene3carboxamide
N(3METHYLPENT1YN3YL)6NITRO2OXOCHROMENE3CARBOXAMIDE
ZINC000000094511
ZINC000000094516
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