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Ethyl 4-([5-(4-chlorophenyl)-3-oxo-1-cyclohexen-1-yl]amino)benzoate
SpectraBase Compound ID 9zYD0gihiVu
InChI InChI=1S/C21H20ClNO3/c1-2-26-21(25)15-5-9-18(10-6-15)23-19-11-16(12-20(24)13-19)14-3-7-17(22)8-4-14/h3-10,13,16,23H,2,11-12H2,1H3
InChIKey UWGXMBORVSWFFP-UHFFFAOYSA-N
Mol Weight 369.85 g/mol
Molecular Formula C21H20ClNO3
Exact Mass 369.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QsdCc3W2Lw
Name Ethyl 4-([5-(4-chlorophenyl)-3-oxo-1-cyclohexen-1-yl]amino)benzoate
CAS Registry Number 309739-83-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20ClNO3
InChI InChI=1S/C21H20ClNO3/c1-2-26-21(25)15-5-9-18(10-6-15)23-19-11-16(12-20(24)13-19)14-3-7-17(22)8-4-14/h3-10,13,16,23H,2,11-12H2,1H3
InChIKey UWGXMBORVSWFFP-UHFFFAOYSA-N
Molecular Weight 369.848 g/mol
SMILES N(C1=CC(=O)CC(C1)c1ccc(cc1)Cl)c1ccc(C(=O)OCC)cc1
SPLASH splash10-0api-4911000000-e86f2b67778e90cf6978
Source of Spectrum AD-0-2532-0
Synonyms 4-[[5-(4-chlorophenyl)-3-keto-cyclohexen-1-yl]amino]benzoic acid ethyl ester 4-[[5-(4-chlorophenyl)-3-oxo-1-cyclohexenyl]amino]benzoic acid ethyl ester Benzoic acid, 4-[5-(4-chlorophenyl)-3-oxo-1-cyclohexenylamino]-, ethyl ester Ethyl 4-[[5-(4-chlorophenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]benzoate Ethyl 4-[[5-(4-chlorophenyl)-3-oxo-cyclohexen-1-yl]amino]benzoate
Wiley ID 1432483