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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24NO4
Molecular Weight 318.3875
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of N-METHYLCOCAINE CATION

SMILES

COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)C3=CC=CC=C3)[N+]2(C)C

InChI

InChIKey=NRJDVMYLISHSNW-XUWVNRHRSA-N
InChI=1S/C18H24NO4/c1-19(2)13-9-10-14(19)16(18(21)22-3)15(11-13)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,9-11H2,1-3H3/q+1/t13-,14+,15-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H24NO4
Molecular Weight 318.3875
Charge 1
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Pathophysiological and pharmacological mechanisms of acute cocaine toxicity in conscious rats.
1992 Sep
The role of peripheral and central sodium channels in mediating brain temperature fluctuations induced by intravenous cocaine.
2006 Oct 30
Rapid EEG desynchronization and EMG activation induced by intravenous cocaine in freely moving rats: a peripheral, nondopamine neural triggering.
2010 Feb
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:21:48 GMT 2023
Edited
by admin
on Sat Dec 16 08:21:48 GMT 2023
Record UNII
H0DEE7N3J2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-METHYLCOCAINE CATION
Common Name English
8-AZONIABICYCLO(3.2.1)OCTANE, 3-(BENZOYLOXY)-2-(METHOXYCARBONYL)-8,8-DIMETHYL-, (1R-(EXO,EXO))-
Common Name English
Code System Code Type Description
CAS
133097-15-1
Created by admin on Sat Dec 16 08:21:48 GMT 2023 , Edited by admin on Sat Dec 16 08:21:48 GMT 2023
PRIMARY
FDA UNII
H0DEE7N3J2
Created by admin on Sat Dec 16 08:21:48 GMT 2023 , Edited by admin on Sat Dec 16 08:21:48 GMT 2023
PRIMARY
PUBCHEM
83829
Created by admin on Sat Dec 16 08:21:48 GMT 2023 , Edited by admin on Sat Dec 16 08:21:48 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY