Vitas-M small molecule compound
(3Z)-3-[2-(4-nitrophenyl)-2-oxoethylidene]piperazin-2-one
Catalog ID
STK847295
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/1\NCCNC1=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 C12H11N3O4 MW 261.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O4/c16-11(7-10-12(17)14-6-5-13-10)8-1-3-9(4-2-8)15(18)19/h1-4,7,13H,5-6H2,(H,14,17)/b10-7-InChIKey
QYKBWIKQMKKURW-YFHOEESVSA-NSynonyms
177901-92-7(3Z)3(2(4nitrophenyl)2oxoethylidene)piperazin2one
(Z)3(2(4nitrophenyl)2oxoethylidene)piperazin2one
177901927
C1CNC(=O)C(=CC(=O)C2=CC=C(C=C2)(N+)(=O)(O))N1
InChI=1SC12H11N3O4c1611(71012(17)14651310)8139(428)15(18)19h14713H56H2(H1417)b107
MFCD02158316
O=C(c1ccc(cc1)(N+)(=O)(O))C=C1NCCNC1=O
ZINC000004951095
ZINC04951095
ZINC4951095
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