Vitas-M small molecule compound

(5E)-5-(hydroxyimino)-4-[(2E)-2-(hydroxyimino)propyl]-4,5,6,7-tetrahydro-2,1,3-benzoxadiazol-4-ol 1-oxide

Catalog ID
STL325167
SMILES [O-][n+]1onc2c1CC/C(=N\O)/C2(O)C/C(=N/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 C9H12N4O5 MW 256.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12N4O5/c1-5(10-15)4-9(14)7(11-16)3-2-6-8(9)12-18-13(6)17/h14-16H,2-4H2,1H3/b10-5+,11-7+
InChIKey
DCNHCIKKNDMGCZ-JRNXONEVSA-N
Synonyms
330982-57-5
(5E)5(hydroxyimino)4((2E)2(hydroxyimino)propyl)4567tetrahydro213benzoxadiazol4ol1oxide
(5E)5hydroxyimino4((2E)2hydroxyiminopropyl)1oxido67dihydro213benzoxadiazol1ium4ol
(E)4hydroxy5(hydroxyimino)4((E)2(hydroxyimino)propyl)4567tetrahydrobenzo(c)(125)oxadiazole1oxide
(O)(n+)1onc2c1CCC(=NO)C2(O)CC(=NO)C
330982575
CC(=NO)CC1(C(=NO)CCC2=(N+)(ON=C21)(O))O
InChI=1SC9H12N4O5c15(1015)49(14)7(1116)3268(9)121813(6)17h1416H24H21H3b105+117+
MFCD00298287
ZINC000004596615
ZINC000004596616

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Available files

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