SpectraBase Spectrum ID |
2rq4JfyyT9M |
Name |
Benzoic acid, 4-[4-(2-chlorophenyl)-3-(4-ethoxyphenyl)-4,6-dihydro-6-oxopyrrolo[3,4-c]pyrazol-5(1H)-yl]-, ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H24ClN3O4 |
InChI |
InChI=1S/C28H24ClN3O4/c1-3-35-20-15-11-17(12-16-20)24-23-25(31-30-24)27(33)32(26(23)21-7-5-6-8-22(21)29)19-13-9-18(10-14-19)28(34)36-4-2/h5-16,26H,3-4H2,1-2H3,(H,30,31) |
InChIKey |
QYNVEBKWLXRNIM-UHFFFAOYSA-N |
Molecular Weight |
501.970 g/mol |
SMILES |
[nH]1nc(c2c1C(N(C2c1c(Cl)cccc1)c1ccc(C(=O)OCC)cc1)=O)-c1ccc(cc1)OCC |
SPLASH |
splash10-0006-9610010000-a650025860502488e6f1 |
Source of Spectrum |
IY-1-4576-2 |
Synonyms |
4-[4-(2-chlorophenyl)-3-(4-ethoxyphenyl)-6-oxo-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester
Ethyl 4-[4-(2-chlorophenyl)-3-(4-ethoxyphenyl)-6-oxo-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate
Ethyl 4-[4-(2-chlorophenyl)-3-(4-ethoxyphenyl)-6-oxidanylidene-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate |
Wiley ID |
1653745 |