Vitas-M small molecule compound

3-nitro-2-(piperazin-1-yl)benzoic acid

Catalog ID
STK695172
SMILES OC(=O)c1cccc(c1N1CCNCC1)[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 C11H13N3O4 MW 251.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3O4/c15-11(16)8-2-1-3-9(14(17)18)10(8)13-6-4-12-5-7-13/h1-3,12H,4-7H2,(H,15,16)
InChIKey
BFBIXTPJJSLRIX-UHFFFAOYSA-N
Synonyms
374063-89-5
374063895
3nitro2(piperazin1yl)benzoicacid
3NITRO2PIPERAZIN1YLBENZOICACID
3NITRO2PIPERAZINYLBENZOICACID
BENZOICACID3NITRO2(1PIPERAZINYL)
C1CN(CCN1)C2=C(C=CC=C2(N+)(=O)(O))C(=O)O
InChI=1SC11H13N3O4c1511(16)82139(14(17)18)10(8)1364125713h1312H47H2(H1516)
MFCD06245327
OC(=O)c1cccc(c1N1CCNCC1)(N+)(=O)(O)
ZINC000006732063
ZINC06732063
ZINC6732063

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Available files

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