Vitas-M small molecule compound
3,5-dinitro-4-[(pyridin-3-ylmethyl)amino]benzoic acid
Catalog ID
STK662279
SMILES [O-][N+](=O)c1cc(cc(c1NCc1cccnc1)[N+](=O)[O-])C(=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 C13H10N4O6 MW 318.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N4O6/c18-13(19)9-4-10(16(20)21)12(11(5-9)17(22)23)15-7-8-2-1-3-14-6-8/h1-6,15H,7H2,(H,18,19)InChIKey
KUELIABHYXYLEG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(cc(c1NCc1cccnc1)(N+)(=O)(O))C(=O)O
35DINITRO4((3PYRIDYLMETHYL)AMINO)BENZOICACID
35dinitro4((pyridin3ylmethyl)amino)benzoicacid
35DINITRO4(PYRIDIN3YLMETHYLAMINO)BENZOICACID
C1=CC(=CN=C1)CNC2=C(C=C(C=C2(N+)(=O)(O))C(=O)O)(N+)(=O)(O)
InChI=1SC13H10N4O6c1813(19)9410(16(20)21)12(11(59)17(22)23)15782131468h1615H7H2(H1819)
MFCD01029121
ZINC000004182405
ZINC4182405
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