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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H34NO.I
Molecular Weight 455.4159
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEXTROMETHORPHAN BUTYL IODIDE

SMILES

[I-].[H][C@]12CCCC[C@]13CC[N@+](C)(CCCC)[C@H]2CC4=CC=C(OC)C=C34

InChI

InChIKey=BINUHVCXGXUKCP-FUEOYCCASA-M
InChI=1S/C22H34NO.HI/c1-4-5-13-23(2)14-12-22-11-7-6-8-19(22)21(23)15-17-9-10-18(24-3)16-20(17)22;/h9-10,16,19,21H,4-8,11-15H2,1-3H3;1H/q+1;/p-1/t19-,21+,22+,23?;/m1./s1

HIDE SMILES / InChI

Molecular Formula C22H34NO
Molecular Weight 328.5115
Charge 1
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 3 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula I
Molecular Weight 126.9045
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:36:54 GMT 2023
Edited
by admin
on Sat Dec 16 18:36:54 GMT 2023
Record UNII
9JZ8KXB944
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEXTROMETHORPHAN BUTYL IODIDE
Common Name English
Morphinanium, 17-butyl-3-methoxy-17-methyl-, iodide, (9α,13α,14α)-
Systematic Name English
Code System Code Type Description
FDA UNII
9JZ8KXB944
Created by admin on Sat Dec 16 18:36:54 GMT 2023 , Edited by admin on Sat Dec 16 18:36:54 GMT 2023
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CAS
94731-49-4
Created by admin on Sat Dec 16 18:36:54 GMT 2023 , Edited by admin on Sat Dec 16 18:36:54 GMT 2023
PRIMARY
PUBCHEM
167713254
Created by admin on Sat Dec 16 18:36:54 GMT 2023 , Edited by admin on Sat Dec 16 18:36:54 GMT 2023
PRIMARY