3-[2-(2,6-dichlorobenzyl)oxyphenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester

SpectraBase Compound ID	FkiVY4LFp1p
InChI	InChI=1S/C34H32Cl2N4O4/c1-2-43-34(41)32-37-40(26-9-4-3-5-10-26)33(39(32)25-17-15-24(16-18-25)38-19-21-42-22-20-38)27-11-6-7-14-31(27)44-23-28-29(35)12-8-13-30(28)36/h3-18,33H,2,19-23H2,1H3
InChIKey	VPIAHHVKSFQFQK-UHFFFAOYSA-N Google Search
Mol Weight	631.6 g/mol
Molecular Formula	C34H32Cl2N4O4
Exact Mass	630.180061 g/mol

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SpectraBase Spectrum ID	8WVComVPuCU
Name	3-[2-(2,6-dichlorobenzyl)oxyphenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester
Alternate Name(s)	3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]-4-[4-(4-morpholinyl)phenyl]-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester Ethyl 3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]-4-(4-morpholin-4-ylphenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate Ethyl 3-[2-[(2,6-dichlorophenyl)methoxy]phenyl]-4-(4-morpholinophenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate Ethyl 3-[2-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]-4-(4-morpholin-4-ylphenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C34H32Cl2N4O4
InChI	InChI=1S/C34H32Cl2N4O4/c1-2-43-34(41)32-37-40(26-9-4-3-5-10-26)33(39(32)25-17-15-24(16-18-25)38-19-21-42-22-20-38)27-11-6-7-14-31(27)44-23-28-29(35)12-8-13-30(28)36/h3-18,33H,2,19-23H2,1H3
InChIKey	VPIAHHVKSFQFQK-UHFFFAOYSA-N
Molecular Weight	631.560 g/mol
SMILES	C=1(N(C(c2c(OCc3c(Cl)cccc3Cl)cccc2)N(N1)c1ccccc1)c1ccc(N2CCOCC2)cc1)C(=O)OCC
SPLASH	splash10-003r-2819003000-fb6739c835c73e2c02b6
Wiley ID	1437472