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1(2H)-Naphthalenenone, 3,4-dihydro-4-methyl-2-piperidinomethyl-, hydrochloride

HCID 50937
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Basic information

CAS
69928-47-8
Standard SMILES
CC1CC(C[NH+]2CCCCC2)C(=O)c2ccccc21.[Cl-]
InChIKey
TYWRLBWWMOTOIV-UHFFFAOYSA-N
Molecular formula
C17H24ClNO
Average molar mass
293.8 g/mol
Monoisotopic mass
293.1546421

Names & identifiers

Preferred name
1(2H)-Naphthalenenone, 3,4-dihydro-4-methyl-2-piperidinomethyl-, hydrochloride
IUPAC
4-methyl-2-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-one chloride

Names & synonyms

N 6422-Piperidinomethyl-4-methyl-1-tetralone hydrochloride3,4-Dihydro-4-methyl-2-piperidinyl-1(2H)-napthalenone hydrochloride1(2H)-NAPHTHALENENONE, 3,4-DIHYDRO-4-METHYL-2-PIPERIDINOMETHYL-, HYDROCHLORIDE69928-47-8RefChem:211490

Database identifiers

CAS
69928-47-8
PubChem CID
50937

Properties

Computed structural properties

Topological polar surface area
21.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
321

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