Vitas-M small molecule compound

7-[2-(3-nitro-1H-1,2,4-triazol-1-yl)ethoxy]-2H-chromen-2-one

Catalog ID
STK734645
SMILES O=c1ccc2c(o1)cc(cc2)OCCn1cnc(n1)[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 C13H10N4O5 MW 302.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N4O5/c18-12-4-2-9-1-3-10(7-11(9)22-12)21-6-5-16-8-14-13(15-16)17(19)20/h1-4,7-8H,5-6H2
InChIKey
ZZELTMUPPBGIKZ-UHFFFAOYSA-N
Synonyms

7(2(3NITRO(124)TRIAZOL1YL)ETHOXY)CHROMEN2ONE
7(2(3NITRO124TRIAZOL1YL)ETHOXY)CHROMEN2ONE
7(2(3NITRO124TRIAZOLYL)ETHOXY)CHROMEN2ONE
7(2(3nitro1H124triazol1yl)ethoxy)2Hchromen2one
C1=CC(=CC2=C1C=CC(=O)O2)OCCN3C=NC(=N3)(N+)(=O)(O)
InChI=1SC13H10N4O5c18124291310(711(9)2212)21651681413(1516)17(19)20h1478H56H2
MFCD03763567
O=c1ccc2c(o1)cc(cc2)OCCn1cnc(n1)(N+)(=O)(O)
ZINC000000033801
ZINC00033801
ZINC33801

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Available files

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