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5',6'-Dimethoxy-1'-methyl-2',3',8',8'a-tetrahydro-1'H-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-one

HCID 200480
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Basic informationNames & identifiersRelated reactionsCompound notes
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Basic information

CAS
2128-60-1
Standard SMILES
COc1cc2c3c(c1OC)C1(C=CC(=O)C=C1)C[C@H]3N(C)CC2
InChIKey
WUYQEGNOQLRQAQ-CQSZACIVSA-N
Molecular formula
C19H21NO3
Average molar mass
311.381 g/mol
Monoisotopic mass
311.15214353

Names & identifiers

Preferred name
5',6'-Dimethoxy-1'-methyl-2',3',8',8'a-tetrahydro-1'H-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-one
IUPAC
(8'aR)-5',6'-Dimethoxy-1'-methyl-2',3',8',8'a-tetrahydro-1'H-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-one

Database identifiers

CAS
2128-60-1
PubChem CID
200480
DTXSID
DTXSID60943782
ChEMBL
CHEMBL237766
ChEBI
CHEBI:42
UNII
860X46GII1
Nikkaji
J20.736E

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