Vitas-M small molecule compound

methyl 3-[(3-methoxyphenyl)carbamoyl]-5-nitrobenzoate

Catalog ID
STK087423
SMILES COc1cccc(c1)NC(=O)c1cc(cc(c1)C(=O)OC)[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 C16H14N2O6 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O6/c1-23-14-5-3-4-12(9-14)17-15(19)10-6-11(16(20)24-2)8-13(7-10)18(21)22/h3-9H,1-2H3,(H,17,19)
InChIKey
SHYFMGGYGMWLCV-UHFFFAOYSA-N
Synonyms
348605-17-4
348605174
COC1=CC=CC(=C1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COc1cccc(c1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
InChI=1SC16H14N2O6c1231453412(914)1715(19)10611(16(20)242)813(710)18(21)22h39H12H3(H1719)
METHYL3((3METHOXYPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(3METHOXYPHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196903
STK087423
ZINC000000183855
ZINC00183855
ZINC183855

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.