Spiro(naphthalene-1(2H),3'-pyrrolidine)-2',5'-dione, 3,4-dihydro-1'-(3-(dimethylamino)butyl)-, hydrochloride, (+-)-

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Basic information

CAS: 74247-02-2
Standard SMILES: C[C@@H](CCN1C(=O)C[C@]2(CCCc3ccccc32)C1=O)N(C)C.Cl
InChIKey: JOFCMQINIAQNCD-JPJJPTBZSA-N
Molecular formula: C19H27ClN2O2
Average molar mass: 350.9 g/mol
Monoisotopic mass: 350.1761058

Names & identifiers

Preferred name: Spiro(naphthalene-1(2H),3'-pyrrolidine)-2',5'-dione, 3,4-dihydro-1'-(3-(dimethylamino)butyl)-, hydrochloride, (+-)-
IUPAC: (4S)-1'-[(3S)-3-(dimethylamino)butyl]spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride

Names & synonyms

74247-02-2Spiro(naphthalene-1(2H),3'-pyrrolidine)-2',5'-dione, 3,4-dihydro-1'-(3-(dimethylamino)butyl)-, hydrochloride, (+-)-RefChem:381154DTXSID50995755(1S)-1'-[(3S)-3-(Dimethylamino)butyl]-3,4-dihydro-2H-spiro[naphthalene-1,3'-pyrrolidine]-2',5'-dione--hydrogen chloride (1/1)1'-[3-(Dimethylamino)butyl]-3,4-dihydro-2H-spiro[naphthalene-1,3'-pyrrolidine]-2',5'-dione--hydrogen chloride (1/1)

Database identifiers

CAS: 74247-02-2
PubChem CID: 5746367
DTXSID: DTXSID50995755

Properties

Computed structural properties

Topological polar surface area: 40.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 24
Formal charge: 0
Complexity: 476

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Compound notes

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