Dmteh

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Basic information

CAS: 87988-85-0
Standard SMILES: Cc1c2c(c(C)c3c1[NH2+]c1ccccc1-3)C[N+](C)(C)CC2.[OH-]
InChIKey: JPKKPORVRTXKFL-UHFFFAOYSA-N
Molecular formula: C19H25N2O+
Average molar mass: 297.4 g/mol
Monoisotopic mass: 297.19668843

Names & identifiers

Preferred name: Dmteh
IUPAC: 2,2,5,11-tetramethyl-1,3,4,6-tetrahydropyrido[4,3-b]carbazole-2,6-diium hydroxide
English name: N,N-dimethyltetrahydroellipticine
Molecular formula: C19H25N2O+
Molecular weight: 297.4146

Names & synonyms

DMTEH87988-85-0N,N-DimethyltetrahydroellipticineN,N-Dimethyltetrahydroellipticinium hydroxide2,2,5,11-tetramethyl-1,3,4,6-tetrahydropyrido[4,3-b]carbazole-2,6-diium;hydroxide1H-Pyrido(4,3-b)carbazolium, 2,3,4,6-tetrahydro-2,2,5,11-tetramethyl-, hydroxide

Database identifiers

CAS: 87988-85-0
PubChem CID: 137374

Properties

Computed structural properties

Topological polar surface area: 17.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 22
Formal charge: 1
Complexity: 404

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Compound notes

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