Vitas-M small molecule compound
methyl 3-nitro-5-[(1-phenylethyl)carbamoyl]benzoate
Catalog ID
STK049158
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(c1ccccc1)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 C17H16N2O5 MW 328.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5/c1-11(12-6-4-3-5-7-12)18-16(20)13-8-14(17(21)24-2)10-15(9-13)19(22)23/h3-11H,1-2H3,(H,18,20)InChIKey
IKRSXQRMIUTUID-UHFFFAOYSA-NSynonyms
124215-35-6124215356
CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)NC(c1ccccc1)C
InChI=1SC17H16N2O5c111(126435712)1816(20)13814(17(21)242)1015(913)19(22)23h311H12H3(H1820)
METHYL3NITRO5((1PHENYLETHYL)CARBAMOYL)BENZOATE
METHYL3NITRO5(1PHENYLETHYLCARBAMOYL)BENZOATE
METHYL3NITRO5(N(PHENYLETHYL)CARBAMOYL)BENZOATE
MFCD01196944
STK049158
ZINC000000060827
ZINC000000060828
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