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3-[(4-chlorophenyl)sulfonylamino]-3-(4-ethoxyphenyl)propanoic acid

View entire compound with spectra: 1 MS (GC)

3-[(4-chlorophenyl)sulfonylamino]-3-(4-ethoxyphenyl)propanoic acid
SpectraBase Compound ID JjdgckROmG1
InChI InChI=1S/C17H18ClNO5S/c1-2-24-14-7-3-12(4-8-14)16(11-17(20)21)19-25(22,23)15-9-5-13(18)6-10-15/h3-10,16,19H,2,11H2,1H3,(H,20,21)
InChIKey BOKQPJNHCCCCOO-UHFFFAOYSA-N
Mol Weight 383.85 g/mol
Molecular Formula C17H18ClNO5S
Exact Mass 383.059422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3m5IVPrNlw
Name 3-[(4-chlorophenyl)sulfonylamino]-3-(4-ethoxyphenyl)propanoic acid
Alternate Name(s) 3-[(4-chlorophenyl)sulfonylamino]-3-p-phenetyl-propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClNO5S
InChI InChI=1S/C17H18ClNO5S/c1-2-24-14-7-3-12(4-8-14)16(11-17(20)21)19-25(22,23)15-9-5-13(18)6-10-15/h3-10,16,19H,2,11H2,1H3,(H,20,21)
InChIKey BOKQPJNHCCCCOO-UHFFFAOYSA-N
Molecular Weight 383.846 g/mol
SMILES OC(CC(c1ccc(cc1)OCC)NS(=O)(=O)c1ccc(cc1)Cl)=O
SPLASH splash10-02mi-5912000000-53dae2dfac120b89e71b
Wiley ID 1443931