Compound C16H18ClNOS

(4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methylazanium chloride

CAS: 82394-04-5

Molecular Formula	`C16H18ClNOS`
Molecular Weight	307.8 g/mol
Topological Polar Surface Area	62.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	307.07977
Heavy Atoms	20
Complexity	298.0

Chemical Identifiers

CAS Number	82394-04-5
SMILES	`COC1=CC=CC2=C1SCC3=CC=CC=C3C2C[NH3+].[Cl-]`
InChIKey	`PXGYEECDKXXTOQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H18ClNOS (CAS: 82394-04-5) is a chemical compound with molecular formula C16H18ClNOS and molecular weight 307.8 g/mol. Its IUPAC systematic name is (4-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)methylazanium chloride. Topological Polar Surface Area 62.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 307.07977 Heavy Atoms 20 Complexity 298.0 InChI Key: PXGYEECDKXXTOQ-UHFFFAOYSA-N. SMILES: COC1=CC=CC2=C1SCC3=CC=CC=C3C2C[NH3+].[Cl-].

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