Vitas-M small molecule compound

2,2-dimethyl-3-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}cyclopropanecarboxylic acid

Catalog ID
STK504910
SMILES OC(=O)C1C(C1(C)C)C(=O)N1CCN(CC1)c1ccc(cc1)[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 C17H21N3O5 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O5/c1-17(2)13(14(17)16(22)23)15(21)19-9-7-18(8-10-19)11-3-5-12(6-4-11)20(24)25/h3-6,13-14H,7-10H2,1-2H3,(H,22,23)
InChIKey
NXOJDWWMFVLDHT-UHFFFAOYSA-N
Synonyms
1142214-93-4
1142214934
22DIMETHYL3((4(4NITROPHENYL)PIPERAZIN1YL)CARBONYL)CYCLOPROPANECARBOXYLICACID
22DIMETHYL3(4(4NITROPHENYL)PIPERAZINE1CARBONYL)CYCLOPROPANE1CARBOXYLICACID
22DIMETHYL3(4(4NITROPHENYL)PIPERAZINE1CARBONYL)CYCLOPROPANECARBOXYLICACID
CC1(C(C1C(=O)O)C(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC17H21N3O5c117(2)13(14(17)16(22)23)15(21)199718(81019)113512(6411)20(24)25h361314H710H212H3(H2223)
MFCD12027542
OC(=O)C1C(C1(C)C)C(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000034926366
ZINC000034926369

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Available files

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