Vitas-M small molecule compound
methyl 3-[(4-chlorobenzyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK323232
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NCc1ccc(cc1)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/c1-24-16(21)12-6-11(7-14(8-12)19(22)23)15(20)18-9-10-2-4-13(17)5-3-10/h2-8H,9H2,1H3,(H,18,20)InChIKey
RNAGYUFWOIULCB-UHFFFAOYSA-NSynonyms
431986-48-0431986480
COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)Cl)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)NCc1ccc(cc1)Cl
InChI=1SC16H13ClN2O5c12416(21)12611(714(812)19(22)23)15(20)189102413(17)5310h28H9H21H3(H1820)
methyl3((4chlorobenzyl)carbamoyl)5nitrobenzoate
METHYL3((4CHLOROPHENYL)METHYLCARBAMOYL)5NITROBENZOATE
METHYL5(N((4CHLOROPHENYL)METHYL)CARBAMOYL)3NITROBENZOATE
MFCD03143170
ZINC000000859654
ZINC00859654
ZINC859654
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