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Carbostyril, 3,4-dihydro-1-(2-(methylphenethylamino)propyl)-, oxalate

HCID 58227
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Basic information

CAS
101227-66-1
Standard SMILES
CC(CN1C(=O)CCc2ccccc21)[NH+](C)CCc1ccccc1.O=C([O-])C(=O)O
InChIKey
RGQXJWIZBHPCIM-UHFFFAOYSA-N
Molecular formula
C23H28N2O5
Average molar mass
412.5 g/mol
Monoisotopic mass
412.199822

Names & identifiers

Preferred name
Carbostyril, 3,4-dihydro-1-(2-(methylphenethylamino)propyl)-, oxalate
IUPAC
2-hydroxy-2-oxoacetate;methyl-[1-(2-oxo-3,4-dihydroquinolin-1-yl)propan-2-yl]-(2-phenylethyl)azanium

Names & synonyms

3,4-Dihydro-1-(2-(methylphenethylamino)propyl)carbostyril oxalate101227-66-1CARBOSTYRIL, 3,4-DIHYDRO-1-(2-(METHYLPHENETHYLAMINO)PROPYL)-, OXALATERefChem:333553

Database identifiers

CAS
101227-66-1
PubChem CID
58227

Properties

Computed structural properties

Topological polar surface area
102 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
483

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