Carbazole, 9-(3-dimethylaminopropyl)-1-methoxy-, oxalate

HCID 38992

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Basic information

CAS: 41734-76-3
Standard SMILES: COc1cccc2c3ccccc3n(CCC[NH+](C)C)c12.O=C([O-])C(=O)O
InChIKey: XQABLDBORQXLQH-UHFFFAOYSA-N
Molecular formula: C20H24N2O5
Average molar mass: 372.4 g/mol
Monoisotopic mass: 372.16852187

Names & identifiers

Preferred name: Carbazole, 9-(3-dimethylaminopropyl)-1-methoxy-, oxalate
IUPAC: 2-hydroxy-2-oxoacetate;3-(1-methoxycarbazol-9-yl)propyl-dimethylazanium

Names & synonyms

41734-76-3CARBAZOLE, 9-(3-DIMETHYLAMINOPROPYL)-1-METHOXY-, OXALATE9-(3-Dimethylaminopropyl)-1-methoxycarbazole oxalateDTXSID90194548Propylamine, N,N-dimethyl-3-(1-methoxycarbazol-9-yl)-, oxalateRefChem:333295DTXCID301170393-(1-Methoxy-9H-carbazol-9-yl)-N,N-dimethylpropan-1-aminium hydrogen ethanedioate

Database identifiers

CAS: 41734-76-3
PubChem CID: 38992
DTXSID: DTXSID90194548

Properties

Computed structural properties

Topological polar surface area: 96 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 27
Formal charge: 0
Complexity: 411

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