Vitas-M small molecule compound
1-(chloromethyl)-2-methyl-4-[(4-nitrobenzyl)oxy]-5-(propan-2-yl)benzene
Catalog ID
STK663866
SMILES ClCc1cc(C(C)C)c(cc1C)OCc1ccc(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 C18H20ClNO3 MW 333.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO3/c1-12(2)17-9-15(10-19)13(3)8-18(17)23-11-14-4-6-16(7-5-14)20(21)22/h4-9,12H,10-11H2,1-3H3InChIKey
YSQLZHMGZAPIGP-UHFFFAOYSA-NSynonyms
1(chloromethyl)2methyl4((4nitrobenzyl)oxy)5(propan2yl)benzene
1(CHLOROMETHYL)2METHYL4((4NITROPHENYL)METHOXY)5PROPAN2YLBENZENE
CC1=CC(=C(C=C1CCl)C(C)C)OCC2=CC=C(C=C2)(N+)(=O)(O)
ClCc1cc(C(C)C)c(cc1C)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H20ClNO3c112(2)17915(1019)13(3)818(17)2311144616(7514)20(21)22h4912H1011H213H3
MFCD02018960
ZINC000000087473
ZINC00087473
ZINC87473
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