SpectraBase Spectrum ID |
JNq2f03OqbZ |
Name |
6-[3-(4-chlorobenzoyl)-2-(4-fluorophenyl)-4-(3-methylanilino)-5-oxo-2H-pyrrol-1-yl]hexanoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H28ClFN2O4 |
InChI |
InChI=1S/C30H28ClFN2O4/c1-19-6-5-7-24(18-19)33-27-26(29(37)21-9-13-22(31)14-10-21)28(20-11-15-23(32)16-12-20)34(30(27)38)17-4-2-3-8-25(35)36/h5-7,9-16,18,28,33H,2-4,8,17H2,1H3,(H,35,36) |
InChIKey |
XDCFFJPBQMJARW-UHFFFAOYSA-N |
Molecular Weight |
535.015 g/mol |
SMILES |
OC(CCCCCN1C(C(=C(C1=O)Nc1cc(C)ccc1)C(c1ccc(cc1)Cl)=O)c1ccc(cc1)F)=O |
SPLASH |
splash10-000l-9500000000-1815407ada096b1d2315 |
Synonyms |
6-[3-(4-chlorobenzoyl)-2-(4-fluorophenyl)-5-keto-4-(m-toluidino)-3-pyrrolin-1-yl]hexanoic acid
6-[3-(4-chlorophenyl)carbonyl-2-(4-fluorophenyl)-4-[(3-methylphenyl)amino]-5-oxidanylidene-2H-pyrrol-1-yl]hexanoic acid
6-[3-[(4-chlorophenyl)-oxomethyl]-2-(4-fluorophenyl)-4-(3-methylanilino)-5-oxo-2H-pyrrol-1-yl]hexanoic acid |
Wiley ID |
1457857 |