Benzoic acid, 2-[3-[[(3,4-dihydroxyphenyl)acetyl]amino]propoxy]-

SpectraBase Compound ID	1NRPB1gbVgN
InChI	InChI=1S/C18H19NO6/c20-14-7-6-12(10-15(14)21)11-17(22)19-8-3-9-25-16-5-2-1-4-13(16)18(23)24/h1-2,4-7,10,20-21H,3,8-9,11H2,(H,19,22)(H,23,24)
InChIKey	JNFLVOOGBDGMAX-UHFFFAOYSA-N Google Search
Mol Weight	345.35 g/mol
Molecular Formula	C18H19NO6
Exact Mass	345.121237 g/mol

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SpectraBase Spectrum ID	8ze5jbRGG3T
Name	Benzoic acid, 2-[3-[[(3,4-dihydroxyphenyl)acetyl]amino]propoxy]-
Alternate Name(s)	2-(3-{[(3,4-dihydroxyphenyl)acetyl]amino}propoxy)benzoic acid N-[3-(2-carboxyphenoxy)propyl]-3,4-dihydroxyphenylacetamide
CAS Registry Number	115149-65-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H19NO6
InChI	InChI=1S/C18H19NO6/c20-14-7-6-12(10-15(14)21)11-17(22)19-8-3-9-25-16-5-2-1-4-13(16)18(23)24/h1-2,4-7,10,20-21H,3,8-9,11H2,(H,19,22)(H,23,24)
InChIKey	JNFLVOOGBDGMAX-UHFFFAOYSA-N
Molecular Weight	345.351 g/mol
SMILES	OC(c1c(OCCCNC(Cc2ccc(c(c2)O)O)=O)cccc1)=O
SPLASH	splash10-05fr-2930000000-b5d271a31e1bc534c5b3
Source of Spectrum	KC-1988-82-24
Wiley ID	1338624