4-[methyl(octadecyl)amino]-3-nitro-benzoic acid

SpectraBase Compound ID	33oArlZZt7M
InChI	InChI=1S/C26H44N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-27(2)24-20-19-23(26(29)30)22-25(24)28(31)32/h19-20,22H,3-18,21H2,1-2H3,(H,29,30)
InChIKey	CITOGJZWCOOZGD-UHFFFAOYSA-N Google Search
Mol Weight	448.6 g/mol
Molecular Formula	C26H44N2O4
Exact Mass	448.330108 g/mol

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SpectraBase Spectrum ID	HNZdK2kMBxN
Name	4-[methyl(octadecyl)amino]-3-nitro-benzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H44N2O4
InChI	InChI=1S/C26H44N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-27(2)24-20-19-23(26(29)30)22-25(24)28(31)32/h19-20,22H,3-18,21H2,1-2H3,(H,29,30)
InChIKey	CITOGJZWCOOZGD-UHFFFAOYSA-N
Molecular Weight	448.648 g/mol
SMILES	OC(c1cc(N(=O)=O)c(cc1)N(CCCCCCCCCCCCCCCCCC)C)=O
SPLASH	splash10-0a4l-9360000000-02e0e864677e9b8e96e2
Source of Spectrum	IC-1182-0-0
Synonyms	4-[methyl(stearyl)amino]-3-nitro-benzoic acid
Wiley ID	1387247