Vitas-M small molecule compound
4-chloro-N-(cyanomethyl)-2-nitrobenzamide
Catalog ID
STK032649
SMILES N#CCNC(=O)c1ccc(cc1[N+](=O)[O-])Cl
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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 C9H6ClN3O3 MW 239.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6ClN3O3/c10-6-1-2-7(8(5-6)13(15)16)9(14)12-4-3-11/h1-2,5H,4H2,(H,12,14)InChIKey
QYIPGXVOMSQAFM-UHFFFAOYSA-NSynonyms
22978-09-2(4CHLORO2NITROPHENYL)N(CYANOMETHYL)CARBOXAMIDE
22978092
4CHLORON(CYANOMETHYL)2NITROBENZAMIDE
4CHLORONCYANOMETHYL2NITROBENZAMIDE
C1=CC(=C(C=C1Cl)(N+)(=O)(O))C(=O)NCC#N
InChI=1SC9H6ClN3O3c106127(8(56)13(15)16)9(14)124311h125H4H2(H1214)
MFCD01215354
N#CCNC(=O)c1ccc(cc1(N+)(=O)(O))Cl
STK032649
ZINC000004662554
ZINC04662554
ZINC4662554
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