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3-[4-(2,5-dichlorophenyl)piperazine-1-carbonyl]-8-methoxy-coumarin
SpectraBase Compound ID BG9pTDROCA7
InChI InChI=1S/C21H18Cl2N2O4/c1-28-18-4-2-3-13-11-15(21(27)29-19(13)18)20(26)25-9-7-24(8-10-25)17-12-14(22)5-6-16(17)23/h2-6,11-12H,7-10H2,1H3
InChIKey AQODISXMILYBPS-UHFFFAOYSA-N
Mol Weight 433.29 g/mol
Molecular Formula C21H18Cl2N2O4
Exact Mass 432.064362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHprSC1kZ80
Name 3-[4-(2,5-dichlorophenyl)piperazine-1-carbonyl]-8-methoxy-coumarin
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Formula C21H18Cl2N2O4
InChI InChI=1S/C21H18Cl2N2O4/c1-28-18-4-2-3-13-11-15(21(27)29-19(13)18)20(26)25-9-7-24(8-10-25)17-12-14(22)5-6-16(17)23/h2-6,11-12H,7-10H2,1H3
InChIKey AQODISXMILYBPS-UHFFFAOYSA-N
Molecular Weight 433.291 g/mol
SMILES C=1(C(Oc2c(C1)cccc2OC)=O)C(N1CCN(c2cc(Cl)ccc2Cl)CC1)=O
SPLASH splash10-0udi-4690000000-0286012c062a42874789
Synonyms 3-[4-[2,5-bis(chloranyl)phenyl]piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one 3-[[4-(2,5-dichlorophenyl)-1-piperazinyl]-oxomethyl]-8-methoxy-1-benzopyran-2-one 3-[4-(2,5-dichlorophenyl)piperazine-1-carbonyl]-8-methoxychromen-2-one
Wiley ID 1445582