Diphenyl {2-[(Butylamino)carbonyl]-1,2-dihydroisoquinolin-1-yl}phosphonate

SpectraBase Compound ID	BqxYBA44HgD
InChI	InChI=1S/C26H27N2O4P/c1-2-3-19-27-26(29)28-20-18-21-12-10-11-17-24(21)25(28)33(30,31-22-13-6-4-7-14-22)32-23-15-8-5-9-16-23/h4-18,20,25H,2-3,19H2,1H3,(H,27,29)
InChIKey	NNRJGIMSXQHXEL-UHFFFAOYSA-N Google Search
Mol Weight	462.49 g/mol
Molecular Formula	C26H27N2O4P
Exact Mass	462.170844 g/mol

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SpectraBase Spectrum ID	123sbBIHTs
Name	Diphenyl {2-[(Butylamino)carbonyl]-1,2-dihydroisoquinolin-1-yl}phosphonate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H27N2O4P
InChI	InChI=1S/C26H27N2O4P/c1-2-3-19-27-26(29)28-20-18-21-12-10-11-17-24(21)25(28)33(30,31-22-13-6-4-7-14-22)32-23-15-8-5-9-16-23/h4-18,20,25H,2-3,19H2,1H3,(H,27,29)
InChIKey	NNRJGIMSXQHXEL-UHFFFAOYSA-N
Literature Reference DOI	10.1002/hlca.200900247
Molecular Weight	462.486 g/mol
SMILES	N(CCCC)C(=O)N1C(c2ccccc2C=C1)P(Oc1ccccc1)(Oc1ccccc1)=O
SPLASH	splash10-004v-9300000000-1a2dbccd44dbd393620a
Source of Spectrum	H-93-657-4d
Synonyms	diphenyl (2-(butylcarbamoyl)-1,2-dihydroisoquinolin-1-yl)phosphonate
Wiley ID	1783976