Vitas-M small molecule compound
methyl 3-[(3-chloro-2-methylphenyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK118480
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1C)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 C16H13ClN2O5 MW 348.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O5/c1-9-13(17)4-3-5-14(9)18-15(20)10-6-11(16(21)24-2)8-12(7-10)19(22)23/h3-8H,1-2H3,(H,18,20)InChIKey
NWWGMMIAMJQNSN-UHFFFAOYSA-NSynonyms
329931-77-3329931773
CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1cccc(c1C)Cl
InChI=1SC16H13ClN2O5c1913(17)43514(9)1815(20)10611(16(21)242)812(710)19(22)23h38H12H3(H1820)
METHYL3((3CHLORO2METHYLPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(3CHLORO2METHYLPHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196895
ZINC000000060817
ZINC00060817
ZINC60817
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