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78109-80-5 | Benzamide,2-butoxy-N-[4-(diethylamino)-1-methylbutyl]-, hydrochloride (1:1)
CAS No: 78109-80-5 Catalog No: AG0054ZK MDL No:
Product Description
Catalog Number:
AG0054ZK
Chemical Name:
Benzamide,2-butoxy-N-[4-(diethylamino)-1-methylbutyl]-, hydrochloride (1:1)
CAS Number:
78109-80-5
Molecular Formula:
C20H35ClN2O2
Molecular Weight:
370.9571
IUPAC Name:
4-[(2-butoxybenzoyl)amino]pentyl-diethylazanium;chloride
InChI:
InChI=1S/C20H34N2O2.ClH/c1-5-8-16-24-19-14-10-9-13-18(19)20(23)21-17(4)12-11-15-22(6-2)7-3;/h9-10,13-14,17H,5-8,11-12,15-16H2,1-4H3,(H,21,23);1H
InChI Key:
BTDBZXKNUXQXDF-UHFFFAOYSA-N
SMILES:
CCCCOc1ccccc1C(=O)NC(CCC[NH+](CC)CC)C.[Cl-]
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.239g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
370.962g/mol
Monoisotopic Mass:
370.239g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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