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Structure

8-Methoxy-11-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-6H-benzo[c][1]benzothiepin-11-ol chloride

CAS
36547-32-7
Catalog Number
ACM36547327
Category
Other Products
Molecular Weight
484.05 g/mol
Molecular Formula
C27H30ClNO3S

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Specification

Synonyms
AC1L1XT8, LS-61438, 36547-32-7, 8-methoxy-11-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-6H-benzo[c][1]benzothiepin-11-ol chloride, Dibenzo(b,e)thiepin-11-ol, 6,11-dihydro-8-methoxy-11-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)-, hydrochloride
IUPAC Name
8-methoxy-11-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-6H-benzo[c][1]benzothiepin-11-ol;chloride
Canonical SMILES
COC1=CC2=C(C=C1)C(C3=CC=CC=C3SC2)(C4=CC=C(C=C4)OCC[NH+]5CCCC5)O.[Cl-]
InChI Key
YJBVPMJATOZROK-UHFFFAOYSA-N
Exact Mass
483.16300
H-Bond Acceptor
5
H-Bond Donor
2
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