Compound C28H47N3O10

2-(2-butoxy-3-methoxyphenyl)ethyl-bis[2-(propylcarbamoyloxy)ethyl]azanium;3-hydroxy-3-oxopropanoate

CAS: 72017-27-7

Molecular Formula	`C28H47N3O10`
Molecular Weight	585.7 g/mol
Topological Polar Surface Area	177.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	10
Rotatable Bonds	21
Exact Mass	585.3262
Heavy Atoms	41
Complexity	600.0

Chemical Identifiers

CAS Number	72017-27-7
SMILES	`CCCCOC1=C(C=CC=C1OC)CC[NH+](CCOC(=O)NCCC)CCOC(=O)NCCC.C(C(=O)O)C(=O)[O-]`
InChIKey	`UEKQWLDUUOMZPZ-UHFFFAOYSA-N`

📖 Product Overview

Compound C28H47N3O10 (CAS: 72017-27-7) is a chemical compound with molecular formula C28H47N3O10 and molecular weight 585.7 g/mol. Its IUPAC systematic name is 2-(2-butoxy-3-methoxyphenyl)ethyl-bis[2-(propylcarbamoyloxy)ethyl]azanium;3-hydroxy-3-oxopropanoate. Topological Polar Surface Area 177.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 10 Rotatable Bonds 21 Exact Mass 585.3262 Heavy Atoms 41 Complexity 600.0 InChI Key: UEKQWLDUUOMZPZ-UHFFFAOYSA-N. SMILES: CCCCOC1=C(C=CC=C1OC)CC[NH+](CCOC(=O)NCCC)CCOC(=O)NCCC.C(C(=O)O)C(=O)[O-].

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