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8-chloro-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

HCID 178656357
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Basic information

CAS
485810-01-3
Standard SMILES
O=[N+]([O-])c1ccccc1C1Nc2ccc(Cl)cc2C2C=CCC21
InChIKey
NJPIZHHLAIMUSN-UHFFFAOYSA-N
Molecular formula
C18H15ClN2O2
Average molar mass
326.8 g/mol
Monoisotopic mass
326.0822054

Names & identifiers

Preferred name
8-chloro-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
IUPAC
8-chloro-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
English name
8-chloro-4-{2-nitrophenyl}-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Molecular formula
C18H15ClN2O2
Molecular weight
326.7769

Names & synonyms

8-chloro-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline8-chloro-4-{2-nitrophenyl}-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolineOprea1_449121Oprea1_659950AKOS000508344AKOS024302687ST50006899AG-690/131530588-chloro-4-(2-nitrophenyl)-3,4,5,3a,9b-pentahydrocyclopenta[1,2-c]quinoline485810-01-3

Database identifiers

CAS
485810-01-3
PubChem CID
2873617

Properties

Computed structural propertiesFilling in

XLogP
4.8
Topological polar surface area
57.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
23
Formal charge
0
Complexity
492

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