1-Propanone, 1-(4-(ethylsulfonyl)phenyl)-2-methyl-3-(1-piperidinyl)-, hydrochloride

HCID 3053166

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 69566-47-8
Standard SMILES: CCS(=O)(=O)c1ccc(C(=O)C(C)CN2CCCCC2)cc1.Cl
InChIKey: PPZPVVKWBPOQJH-UHFFFAOYSA-N
Molecular formula: C17H26ClNO3S
Average molar mass: 359.9 g/mol
Monoisotopic mass: 359.1321926

Names & identifiers

Preferred name: 1-Propanone, 1-(4-(ethylsulfonyl)phenyl)-2-methyl-3-(1-piperidinyl)-, hydrochloride
IUPAC: 1-(4-ethylsulfonylphenyl)-2-methyl-3-piperidin-1-ylpropan-1-one;hydrochloride

Names & synonyms

1-(4-Ethylsulfonylphenyl)-3-piperidino-2-methylpropanone-1 hydrochloride1-(4-(Ethylsulfonyl)phenyl)-2-methyl-3-(1-piperidinyl)-1-propanone hydrochloride69566-47-81-Propanone, 1-(4-(ethylsulfonyl)phenyl)-2-methyl-3-(1-piperidinyl)-, hydrochlorideRefChem:234838DTXSID009896041-[4-(Ethanesulfonyl)phenyl]-2-methyl-3-(piperidin-1-yl)propan-1-one--hydrogen chloride (1/1)

Database identifiers

CAS: 69566-47-8
PubChem CID: 3053166
DTXSID: DTXSID00989604

Properties

Computed structural properties

Topological polar surface area: 62.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 23
Formal charge: 0
Complexity: 455

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…