Vitas-M small molecule compound

ethyl 4-[1-(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)ethyl]piperazine-1-carboxylate

Catalog ID
STK150093
SMILES CCOC(=O)N1CCN(CC1)/C(=C/1\C(=O)c2c(C1=O)cccc2)/C

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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 C18H20N2O4 MW 328.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4/c1-3-24-18(23)20-10-8-19(9-11-20)12(2)15-16(21)13-6-4-5-7-14(13)17(15)22/h4-7H,3,8-11H2,1-2H3
InChIKey
QCUUAGWDFXOFLM-UHFFFAOYSA-N
Synonyms
351165-20-3
351165203
CCOC(=O)N1CCN(CC1)C(=C1C(=O)c2c(C1=O)cccc2)C
CCOC(=O)N1CCN(CC1)C(=C1C(=O)c2c(C1=O)cccc2)CO
CCOC(=O)N1CCN(CC1)C(=C2C(=O)C3=CC=CC=C3C2=O)C
ETHYL4((13DIOXOCYCLOPENTA(34A)BENZEN2YLIDENE)ETHYL)PIPERAZINECARBOXYLATE
ETHYL4(1(13DIOXO13DIHYDRO2HINDEN2YLIDENE)ETHYL)PIPERAZINE1CARBOXYLATE
ethyl4(1(13dioxo1Hinden2(3H)ylidene)ethyl)piperazine1carboxylatehydrate
ETHYL4(1(13DIOXOINDEN2YLIDENE)ETHYL)PIPERAZINE1CARBOXYLATE
InChI=1SC18H20N2O4c132418(23)2010819(91120)12(2)1516(21)13645714(13)17(15)22h47H3811H212H3
MFCD01448094
ZINC000000193803
ZINC00193803
ZINC193803

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Available files

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