Vitas-M small molecule compound
[4-(3-chloro-4-methylphenyl)piperazin-1-yl](3-nitrophenyl)methanone
Catalog ID
STK769724
SMILES O=C(c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1ccc(c(c1)Cl)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 C18H18ClN3O3 MW 359.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O3/c1-13-5-6-15(12-17(13)19)20-7-9-21(10-8-20)18(23)14-3-2-4-16(11-14)22(24)25/h2-6,11-12H,7-10H2,1H3InChIKey
VAOZHCDIHHFIGB-UHFFFAOYSA-NSynonyms
681840-55-1(4(3chloro4methylphenyl)piperazin1yl)(3nitrophenyl)methanone
1(3CHLORO4METHYLPHENYL)4(3NITROBENZOYL)PIPERAZINE
681840551
CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)(N+)(=O)(O))Cl
InChI=1SC18H18ClN3O3c1135615(1217(13)19)207921(10820)18(23)1432416(1114)22(24)25h261112H710H21H3
MFCD03763544
O=C(c1cccc(c1)(N+)(=O)(O))N1CCN(CC1)c1ccc(c(c1)Cl)C
ZINC000001071965
ZINC01071965
ZINC1071965
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