Vitas-M small molecule compound
(2E)-1-(1H-benzotriazol-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one
Catalog ID
STL261200
SMILES O=C(n1nnc2c1cccc2)/C=C/c1ccccc1[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 C15H10N4O3 MW 294.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N4O3/c20-15(18-14-8-4-2-6-12(14)16-17-18)10-9-11-5-1-3-7-13(11)19(21)22/h1-10H/b10-9+InChIKey
WQDCUIQXTVMMMW-MDZDMXLPSA-NSynonyms
(2E)1(1Hbenzotriazol1yl)3(2nitrophenyl)prop2en1one
(2E)1BENZOTRIAZOLYL3(2NITROPHENYL)PROP2EN1ONE
(E)1(BENZOTRIAZOL1YL)3(2NITROPHENYL)PROP2EN1ONE
C1=CC=C(C(=C1)C=CC(=O)N2C3=CC=CC=C3N=N2)(N+)(=O)(O)
InChI=1SC15H10N4O3c2015(1814842612(14)161718)10911513713(11)19(21)22h110Hb109+
MFCD03638958
O=C(n1nnc2c1cccc2)C=Cc1ccccc1(N+)(=O)(O)
ZINC000004917058
ZINC04917058
ZINC4917058
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