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1H-pyrazole-3-carboxylic acid, 1-methyl-, 4-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]phenyl ester
SpectraBase Compound ID 2v7FPHScdkQ
InChI InChI=1S/C21H19N3O5/c1-3-28-20(26)15-4-8-16(9-5-15)22-19(25)14-6-10-17(11-7-14)29-21(27)18-12-13-24(2)23-18/h4-13H,3H2,1-2H3,(H,22,25)
InChIKey HLCOTFGAIIDJQF-UHFFFAOYSA-N
Mol Weight 393.4 g/mol
Molecular Formula C21H19N3O5
Exact Mass 393.132471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85zyM3ZMTFO
Name 1H-pyrazole-3-carboxylic acid, 1-methyl-, 4-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]phenyl ester
Alternate Name(s) 1-Methyl-3-pyrazolecarboxylic acid[4-[(4-ethoxycarbonylanilino)-oxomethyl]phenyl]ester 1-Methylpyrazole-3-carboxylic acid[4-[(4-carbethoxyphenyl)carbamoyl]phenyl]ester 4-{[4-(ethoxycarbonyl)anilino]carbonyl}phenyl 1-methyl-1H-pyrazole-3-carboxylate [4-[(4-ethoxycarbonylphenyl)carbamoyl]phenyl]1-methylpyrazole-3-carboxylate 1-Methyl-3-pyrazolecarboxylic acid [4-[(4-ethoxycarbonylanilino)-oxomethyl]phenyl] ester [4-[(4-ethoxycarbonylphenyl)carbamoyl]phenyl] 1-methylpyrazole-3-carboxylate
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Formula C21H19N3O5
InChI InChI=1S/C21H19N3O5/c1-3-28-20(26)15-4-8-16(9-5-15)22-19(25)14-6-10-17(11-7-14)29-21(27)18-12-13-24(2)23-18/h4-13H,3H2,1-2H3,(H,22,25)
InChIKey HLCOTFGAIIDJQF-UHFFFAOYSA-N
Molecular Weight 393.399 g/mol
SMILES N(C(c1ccc(OC(c2n[n](C)cc2)=O)cc1)=O)c1ccc(C(=O)OCC)cc1
SPLASH splash10-0a4i-5910000000-493e0466c80d1e4c0af5
Wiley ID 1512143