Vitas-M small molecule compound
ethyl (2Z)-2-cyano-3-[1-(3-nitrophenyl)-1H-pyrrol-2-yl]prop-2-enoate
Catalog ID
STK764554
SMILES CCOC(=O)/C(=C\c1cccn1c1cccc(c1)[N+](=O)[O-])/C#N
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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 C16H13N3O4 MW 311.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4/c1-2-23-16(20)12(11-17)9-13-7-4-8-18(13)14-5-3-6-15(10-14)19(21)22/h3-10H,2H2,1H3/b12-9-InChIKey
JKZLPBUJLIGRGE-XFXZXTDPSA-NSynonyms
CCOC(=O)C(=CC1=CC=CN1C2=CC(=CC=C2)(N+)(=O)(O))C#N
CCOC(=O)C(=Cc1cccn1c1cccc(c1)(N+)(=O)(O))C#N
ethyl(2Z)2cyano3(1(3nitrophenyl)1Hpyrrol2yl)prop2enoate
ETHYL(Z)2CYANO3(1(3NITROPHENYL)PYRROL2YL)PROP2ENOATE
InChI=1SC16H13N3O4c122316(20)12(1117)91374818(13)1453615(1014)19(21)22h310H2H21H3b129
MFCD02933048
ZINC000004543807
ZINC04543807
ZINC4543807
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