Vitas-M small molecule compound

ethyl 4-[(3-nitrophenyl)amino]-4-oxobutanoate

Catalog ID
STK098144
SMILES CCOC(=O)CCC(=O)Nc1cccc(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 C12H14N2O5 MW 266.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O5/c1-2-19-12(16)7-6-11(15)13-9-4-3-5-10(8-9)14(17)18/h3-5,8H,2,6-7H2,1H3,(H,13,15)
InChIKey
BWWBILZBGSXIDU-UHFFFAOYSA-N
Synonyms
149926-37-4
149926374
CCOC(=O)CCC(=O)NC1=CC(=CC=C1)(N+)(=O)(O)
CCOC(=O)CCC(=O)Nc1cccc(c1)(N+)(=O)(O)
ETHYL3(N(3NITROPHENYL)CARBAMOYL)PROPANOATE
ETHYL4((3NITROPHENYL)AMINO)4OXOBUTANOATE
ETHYL4(3NITROANILINO)4OXOBUTANOATE
InChI=1SC12H14N2O5c121912(16)7611(15)13943510(89)14(17)18h358H267H21H3(H1315)
MFCD02105463
STK098144
ZINC000002131964
ZINC02131964
ZINC2131964

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Available files

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