Compound C17H22N2O6S

methyl sulfate;trimethyl-[3-(phenylcarbamoyloxy)phenyl]azanium

CAS: 64050-83-5

Molecular Formula	`C17H22N2O6S`
Molecular Weight	382.4 g/mol
Topological Polar Surface Area	113.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	382.11984
Heavy Atoms	26
Complexity	410.0

Chemical Identifiers

CAS Number	64050-83-5
SMILES	`C[N+](C)(C)C1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2.COS(=O)(=O)[O-]`
InChIKey	`CQGHRZNZXOPOFO-UHFFFAOYSA-N`

📖 Product Overview

Compound C17H22N2O6S (CAS: 64050-83-5) is a chemical compound with molecular formula C17H22N2O6S and molecular weight 382.4 g/mol. Its IUPAC systematic name is methyl sulfate;trimethyl-[3-(phenylcarbamoyloxy)phenyl]azanium. Topological Polar Surface Area 113.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 382.11984 Heavy Atoms 26 Complexity 410.0 InChI Key: CQGHRZNZXOPOFO-UHFFFAOYSA-N. SMILES: C[N+](C)(C)C1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2.COS(=O)(=O)[O-].

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