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Reference substances

Reference substances

IUPAC name:
dimethyl(3-{tricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine

Inventory

EC number:
200-041-6
EC name:
Amitriptyline
CAS number:
50-48-6
CAS number:
50-48-6
Synonyms
Names:
1-Propanamine, 3-(10,11-dihydro-5H-dibenzo[ a,d]cyclohepten-5-ylidene)-N,N-dimethyl-
amitriptyline
Identifier:
IUPAC name
Amitriptyline
3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine

Molecular and structural information

Molecular formula:
C20H23N
Molecular weight:
277.403
SMILES notation:
CN(C)CCC=C1c2ccccc2CCc3ccccc13
InChl:
InChI=1/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3
Structural formula:
Chemical structure

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