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2-Chloranyl-5-[(4-oxidanylidene-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl)sulfonyl]-N-phenyl-benzamide
SpectraBase Compound ID AfD3FCUnio1
InChI InChI=1S/C22H23ClN2O4S/c23-19-11-10-16(14-18(19)22(27)24-15-6-2-1-3-7-15)30(28,29)25-13-12-21(26)17-8-4-5-9-20(17)25/h1-3,6-7,10-11,14,17,20H,4-5,8-9,12-13H2,(H,24,27)
InChIKey ROOGAUYECSHAAP-UHFFFAOYSA-N
Mol Weight 446.95 g/mol
Molecular Formula C22H23ClN2O4S
Exact Mass 446.106706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ffgpfkkaeZ
Name 2-Chloranyl-5-[(4-oxidanylidene-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl)sulfonyl]-N-phenyl-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23ClN2O4S
InChI InChI=1S/C22H23ClN2O4S/c23-19-11-10-16(14-18(19)22(27)24-15-6-2-1-3-7-15)30(28,29)25-13-12-21(26)17-8-4-5-9-20(17)25/h1-3,6-7,10-11,14,17,20H,4-5,8-9,12-13H2,(H,24,27)
InChIKey ROOGAUYECSHAAP-UHFFFAOYSA-N
Molecular Weight 446.949 g/mol
SMILES N(C(c1cc(S(N2C3C(CCCC3)C(CC2)=O)(=O)=O)ccc1Cl)=O)c1ccccc1
SPLASH splash10-0gvx-9720000000-0b6fb204b036261a6807
Synonyms 2-Chloro-5-[(4-keto-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl)sulfonyl]-N-phenyl-benzamide 2-Chloro-5-[(4-oxo-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl)sulfonyl]-N-phenyl-benzamide
Wiley ID 1442516