Compound C16H20BrNO3

4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide

CAS: 15270-26-5

Molecular Formula	`C16H20BrNO3`
Molecular Weight	354.24 g/mol
Topological Polar Surface Area	31.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	353.06265
Heavy Atoms	21
Complexity	312.0

Chemical Identifiers

CAS Number	15270-26-5
SMILES	`CCCCC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC.[Br-]`
InChIKey	`CTIBWDPSPDKXFS-UHFFFAOYSA-M`

📖 Product Overview

Compound C16H20BrNO3 (CAS: 15270-26-5) is a chemical compound with molecular formula C16H20BrNO3 and molecular weight 354.24 g/mol. Its IUPAC systematic name is 4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide. Topological Polar Surface Area 31.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 353.06265 Heavy Atoms 21 Complexity 312.0 InChI Key: CTIBWDPSPDKXFS-UHFFFAOYSA-M. SMILES: CCCCC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC.[Br-].

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