Vitas-M small molecule compound
dipropan-2-yl 5-{[(3-nitrophenyl)carbamoyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK457250
SMILES O=C(Nc1cccc(c1)[N+](=O)[O-])Nc1cc(cc(c1)C(=O)OC(C)C)C(=O)OC(C)C
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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 C21H23N3O7 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O7/c1-12(2)30-19(25)14-8-15(20(26)31-13(3)4)10-17(9-14)23-21(27)22-16-6-5-7-18(11-16)24(28)29/h5-13H,1-4H3,(H2,22,23,27)InChIKey
XFKFUAAFWOXYQQ-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC(C)C
dipropan2yl5(((3nitrophenyl)carbamoyl)amino)benzene13dicarboxylate
DIPROPAN2YL5((3NITROPHENYL)CARBAMOYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC21H23N3O7c112(2)3019(25)14815(20(26)3113(3)4)1017(914)2321(27)221665718(1116)24(28)29h513H14H3(H2222327)
METHYLETHYL3((METHYLETHYL)OXYCARBONYL)5(((3NITROPHENYL)AMINO)CARBONYLAMINO)BENZOATE
MFCD05067518
O=C(Nc1cccc(c1)(N+)(=O)(O))Nc1cc(cc(c1)C(=O)OC(C)C)C(=O)OC(C)C
ZINC000002852986
ZINC02852986
ZINC2852986
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