Vitas-M small molecule compound
methyl 6-chloro-4-(4-chloro-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-9-carboxylate
Catalog ID
STK124285
SMILES COC(=O)c1ccc(c2c1C1C=CCC1C(N2)c1ccc(c(c1)[N+](=O)[O-])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 C20H16Cl2N2O4 MW 419.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2N2O4/c1-28-20(25)13-6-8-15(22)19-17(13)11-3-2-4-12(11)18(23-19)10-5-7-14(21)16(9-10)24(26)27/h2-3,5-9,11-12,18,23H,4H2,1H3InChIKey
QHMGZHAVBAQNRN-UHFFFAOYSA-NSynonyms
COC(=O)C1=C2C3C=CCC3C(NC2=C(C=C1)Cl)C4=CC(=C(C=C4)Cl)(N+)(=O)(O)
COC(=O)c1ccc(c2c1C1C=CCC1C(N2)c1ccc(c(c1)(N+)(=O)(O))Cl)Cl
InChI=1SC20H16Cl2N2O4c12820(25)136815(22)1917(13)1132412(11)18(2319)105714(21)16(910)24(26)27h235911121823H4H21H3
METHYL6CHLORO4(4CHLORO3NITROPHENYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE9CARBOXYLATE
MFCD04128901
ZINC000009833605
ZINC000111478231
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