3-(Diethylamino)propyl 9-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazole-6-carboxylate--hydrogen chloride (1/1)

HCID 29176

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Basic information

CAS: 18638-94-3
Standard SMILES: CC[NH+](CC)CCCOC(=O)c1ccc2c(c1)c1c(n2C)C(=O)CCC1.[Cl-]
InChIKey: SDICYERAKGLDKP-UHFFFAOYSA-N
Molecular formula: C21H29ClN2O3
Average molar mass: 392.9 g/mol
Monoisotopic mass: 392.1866705

Names & identifiers

Preferred name: 3-(Diethylamino)propyl 9-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazole-6-carboxylate--hydrogen chloride (1/1)
IUPAC: diethyl-[3-(9-methyl-8-oxo-6,7-dihydro-5H-carbazole-3-carbonyl)oxypropyl]azanium chloride

Names & synonyms

18638-94-3DTXSID809400763-(Diethylamino)propyl 9-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazole-6-carboxylate--hydrogen chloride (1/1)RefChem:1067070DTXCID9013685515,6,7,8-Tetrahydro-9-methyl-8-oxocarbazole-3-carboxylic acid 3-(diethylamino)propyl ester HClOf 2442Carbazole-3-carboxylic acid, 5,6,7,8-tetrahydro-9-methyl-8-oxo-, 3-(diethylamino)propyl ester,monohydrochloride

Database identifiers

CAS: 18638-94-3
PubChem CID: 29176

Properties

Computed structural properties

Topological polar surface area: 52.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 27
Formal charge: 0
Complexity: 505

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