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4-[(3-chloro-N-(2-chlorobenzoyl)anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID CXuCs1Dt77u
InChI InChI=1S/C23H22Cl2N2O3/c1-4-30-23(29)21-14(2)19(15(3)26-21)13-27(17-9-7-8-16(24)12-17)22(28)18-10-5-6-11-20(18)25/h5-12,26H,4,13H2,1-3H3
InChIKey OYDDZUFPXBNDFT-UHFFFAOYSA-N
Mol Weight 445.35 g/mol
Molecular Formula C23H22Cl2N2O3
Exact Mass 444.100748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38bgzwQehLb
Name 4-[(3-chloro-N-(2-chlorobenzoyl)anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
Alternate Name(s) 4-[(3-chloro-N-[(2-chlorophenyl)-oxomethyl]anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-[(3-chloro-N-(2-chlorobenzoyl)anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 4-[[(3-chlorophenyl)-(2-chlorophenyl)carbonyl-amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22Cl2N2O3
InChI InChI=1S/C23H22Cl2N2O3/c1-4-30-23(29)21-14(2)19(15(3)26-21)13-27(17-9-7-8-16(24)12-17)22(28)18-10-5-6-11-20(18)25/h5-12,26H,4,13H2,1-3H3
InChIKey OYDDZUFPXBNDFT-UHFFFAOYSA-N
Molecular Weight 445.346 g/mol
SMILES [nH]1c(c(c(c1C)CN(C(c1c(Cl)cccc1)=O)c1cc(Cl)ccc1)C)C(=O)OCC
SPLASH splash10-001i-0900000000-48de6ef83d50817aa49a
Wiley ID 1461774