Vitas-M small molecule compound
methyl 4-({[3-nitro-4-(pyrrolidin-1-yl)phenyl]carbonyl}amino)benzoate
Catalog ID
STK132883
SMILES COC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1
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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 C19H19N3O5 MW 369.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5/c1-27-19(24)13-4-7-15(8-5-13)20-18(23)14-6-9-16(17(12-14)22(25)26)21-10-2-3-11-21/h4-9,12H,2-3,10-11H2,1H3,(H,20,23)InChIKey
DUBSGLMNHCLIND-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)(N+)(=O)(O)
COC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCC1
InChI=1SC19H19N3O5c12719(24)134715(8513)2018(23)146916(17(1214)22(25)26)2110231121h4912H231011H21H3(H2023)
METHYL4(((3NITRO4(PYRROLIDIN1YL)PHENYL)CARBONYL)AMINO)BENZOATE
METHYL4((3NITRO4PYRROLIDIN1YLBENZOYL)AMINO)BENZOATE
MFCD03909944
ZINC000004677216
ZINC04677216
ZINC4677216
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