Vitas-M small molecule compound

[4-(3,4-dichlorophenyl)piperazin-1-yl](4-methyl-3-nitrophenyl)methanone

Catalog ID
STK462568
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)N1CCN(CC1)c1ccc(c(c1)Cl)Cl

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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 C18H17Cl2N3O3 MW 394.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N3O3/c1-12-2-3-13(10-17(12)23(25)26)18(24)22-8-6-21(7-9-22)14-4-5-15(19)16(20)11-14/h2-5,10-11H,6-9H2,1H3
InChIKey
RPKVPXWOEUHOKN-UHFFFAOYSA-N
Synonyms
681853-40-7
(4(34dichlorophenyl)piperazin1yl)(4methyl3nitrophenyl)methanone
681853407
CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)(N+)(=O)(O)
InChI=1SC18H17Cl2N3O3c1122313(1017(12)23(25)26)18(24)228621(7922)144515(19)16(20)1114h251011H69H21H3
MFCD03766409
O=C(c1ccc(c(c1)(N+)(=O)(O))C)N1CCN(CC1)c1ccc(c(c1)Cl)Cl
ZINC000001053830
ZINC01053830
ZINC1053830

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Available files

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