Vitas-M small molecule compound

pentyl 3-{[(3-nitrophenyl)carbonyl]amino}benzoate

Catalog ID
STK358762
SMILES CCCCCOC(=O)c1cccc(c1)NC(=O)c1cccc(c1)[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 C19H20N2O5 MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5/c1-2-3-4-11-26-19(23)15-8-5-9-16(12-15)20-18(22)14-7-6-10-17(13-14)21(24)25/h5-10,12-13H,2-4,11H2,1H3,(H,20,22)
InChIKey
AQAMPQWJWDSPDR-UHFFFAOYSA-N
Synonyms

CCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
CCCCCOC(=O)c1cccc(c1)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H20N2O5c1234112619(23)1585916(1215)2018(22)14761017(1314)21(24)25h5101213H2411H21H3(H2022)
MFCD01174283
pentyl3(((3nitrophenyl)carbonyl)amino)benzoate
PENTYL3((3NITROBENZOYL)AMINO)BENZOATE
ZINC000002068051
ZINC02068051
ZINC2068051

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Available files

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