Vitas-M small molecule compound
4-[(3-nitrobenzyl)amino]-4-oxobutanoic acid
Catalog ID
STK894432
SMILES O=C(NCc1cccc(c1)[N+](=O)[O-])CCC(=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 C11H12N2O5 MW 252.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N2O5/c14-10(4-5-11(15)16)12-7-8-2-1-3-9(6-8)13(17)18/h1-3,6H,4-5,7H2,(H,12,14)(H,15,16)InChIKey
VLNBCFNZFJFZFM-UHFFFAOYSA-NSynonyms
910443-57-14((3nitrobenzyl)amino)4oxobutanoicacid
4((3nitrophenyl)methylamino)4oxobutanoicacid
910443571
C1=CC(=CC(=C1)(N+)(=O)(O))CNC(=O)CCC(=O)O
InChI=1SC11H12N2O5c1410(4511(15)16)12782139(68)13(17)18h136H457H2(H1214)(H1516)
MFCD08752875
O=C(NCc1cccc(c1)(N+)(=O)(O))CCC(=O)O
ZINC000012404746
ZINC12404746
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