Vitas-M small molecule compound
(2E)-1-(1H-benzimidazol-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one
Catalog ID
STK873818
SMILES [O-][N+](=O)c1cccc(c1)/C=C/C(=O)n1cnc2c1cccc2
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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 C16H11N3O3 MW 293.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O3/c20-16(18-11-17-14-6-1-2-7-15(14)18)9-8-12-4-3-5-13(10-12)19(21)22/h1-11H/b9-8+InChIKey
VYEZXHFIAHYAAP-CMDGGOBGSA-NSynonyms
71322-75-3(2E)1(1Hbenzimidazol1yl)3(3nitrophenyl)prop2en1one
(2E)1BENZIMIDAZOLYL3(3NITROPHENYL)PROP2EN1ONE
(E)1(1BENZIMIDAZOLYL)3(3NITROPHENYL)2PROPEN1ONE
(E)1(BENZIMIDAZOL1YL)3(3NITROPHENYL)PROP2EN1ONE
(O)(N+)(=O)c1cccc(c1)C=CC(=O)n1cnc2c1cccc2
1BENZOIMIDAZOL1YL3(3NITROPHENYL)PROPENONE
71322753
C1=CC=C2C(=C1)N=CN2C(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC16H11N3O3c2016(18111714612715(14)18)981243513(1012)19(21)22h111Hb98+
MFCD00586122
ZINC000004032119
ZINC04032119
ZINC4032119
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