COPTISINE CHLORIDE

5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaene chloride

CAS: 6020-18-4

Molecular Formula	`C19H14ClNO4`
Molecular Weight	355.8 g/mol
Topological Polar Surface Area	40.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	0
Exact Mass	355.06113
Heavy Atoms	25
Complexity	502.0

Chemical Identifiers

CAS Number	6020-18-4
SMILES	`C1C[N+]2=C(C=C3C=CC4=C(C3=C2)OCO4)C5=CC6=C(C=C51)OCO6.[Cl-]`
InChIKey	`LUXPUVKJHVUJAV-UHFFFAOYSA-M`

📖 Product Overview

COPTISINE CHLORIDE (CAS: 6020-18-4) is a chemical compound with molecular formula C19H14ClNO4 and molecular weight 355.8 g/mol. Its IUPAC systematic name is 5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaene chloride. Topological Polar Surface Area 40.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 0 Exact Mass 355.06113 Heavy Atoms 25 Complexity 502.0 InChI Key: LUXPUVKJHVUJAV-UHFFFAOYSA-M. SMILES: C1C[N+]2=C(C=C3C=CC4=C(C3=C2)OCO4)C5=CC6=C(C=C51)OCO6.[Cl-].

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