3-(2-Chlorophenyl)-3-[(2-keto-8-methoxy-chromene-3-carbonyl)amino]propionic acid ethyl ester

SpectraBase Compound ID	BAxQjFkjoIa
InChI	InChI=1S/C22H20ClNO6/c1-3-29-19(25)12-17(14-8-4-5-9-16(14)23)24-21(26)15-11-13-7-6-10-18(28-2)20(13)30-22(15)27/h4-11,17H,3,12H2,1-2H3,(H,24,26)
InChIKey	PQHHAUBCWXPDQM-UHFFFAOYSA-N Google Search
Mol Weight	429.86 g/mol
Molecular Formula	C22H20ClNO6
Exact Mass	429.097915 g/mol

Subscribe to view the full spectrum.

SpectraBase Spectrum ID	HS1h4pGegdw
Name	3-(2-Chlorophenyl)-3-[(2-keto-8-methoxy-chromene-3-carbonyl)amino]propionic acid ethyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	429.097915062 u
Formula	C22H20ClNO6
InChI	InChI=1S/C22H20ClNO6/c1-3-29-19(25)12-17(14-8-4-5-9-16(14)23)24-21(26)15-11-13-7-6-10-18(28-2)20(13)30-22(15)27/h4-11,17H,3,12H2,1-2H3,(H,24,26)
InChIKey	PQHHAUBCWXPDQM-UHFFFAOYSA-N
Molecular Weight	429.856 g/mol
SMILES	C=1(C(OC2=C(C1)C=CC=C2OC)=O)C(NC(CC(=O)OCC)C=1C(Cl)=CC=CC1)=O