Vitas-M small molecule compound
butyl 4-{[(2,4-dinitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK442895
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=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 C18H17N3O7 MW 387.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O7/c1-2-3-10-28-18(23)12-4-6-13(7-5-12)19-17(22)15-9-8-14(20(24)25)11-16(15)21(26)27/h4-9,11H,2-3,10H2,1H3,(H,19,22)InChIKey
XTUUJOHKSGLHCT-UHFFFAOYSA-NSynonyms
butyl4(((24dinitrophenyl)carbonyl)amino)benzoate
BUTYL4((24BISNITROBENZOYL)AMINO)BENZOATE
BUTYL4((24DINITROBENZOYL)AMINO)BENZOATE
BUTYL4((24DINITROPHENYL)CARBONYLAMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O)
CCCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H17N3O7c123102818(23)124613(7512)1917(22)159814(20(24)25)1116(15)21(26)27h4911H2310H21H3(H1922)
MFCD00593665
ZINC000002068914
ZINC02068914
ZINC2068914
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