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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19NO.ClH
Molecular Weight 289.8
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEFOPAM HYDROCHLORIDE, (S)-

SMILES

Cl.CN1CCO[C@@H](C2=CC=CC=C2)C3=CC=CC=C3C1

InChI

InChIKey=CNNVSINJDJNHQK-LMOVPXPDSA-N
InChI=1S/C17H19NO.ClH/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18;/h2-10,17H,11-13H2,1H3;1H/t17-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C17H19NO
Molecular Weight 253.3389
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:21:33 GMT 2025
Edited
by admin
on Tue Apr 01 16:21:33 GMT 2025
Record UNII
B7REK2R84C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEFOPAM HYDROCHLORIDE, (S)-
Common Name English
(+)-NEFOPAM HYDROCHLORIDE
Preferred Name English
1H-2,5-BENZOXAZOCINE, 3,4,5,6-TETRAHYDRO-5-METHYL-1-PHENYL-, HYDROCHLORIDE (1:1), (1S)-
Systematic Name English
1H-2,5-BENZOXAZOCINE, 3,4,5,6-TETRAHYDRO-5-METHYL-1-PHENYL-, HYDROCHLORIDE, (1S)-
Systematic Name English
1H-2,5-BENZOXAZOCINE, 3,4,5,6-TETRAHYDRO-5-METHYL-1-PHENYL-, HYDROCHLORIDE, (S)-
Systematic Name English
(S)-3,4,5,6-TETRAHYDRO-5-METHYL-1-PHENYL-1H-2,5-BENZOXAZOCINE HYDROCHLORIDE
Systematic Name English
(S)-NEFOPAM HYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
53648-31-0
Created by admin on Tue Apr 01 16:21:33 GMT 2025 , Edited by admin on Tue Apr 01 16:21:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID30201886
Created by admin on Tue Apr 01 16:21:33 GMT 2025 , Edited by admin on Tue Apr 01 16:21:33 GMT 2025
PRIMARY
ECHA (EC/EINECS)
258-684-3
Created by admin on Tue Apr 01 16:21:33 GMT 2025 , Edited by admin on Tue Apr 01 16:21:33 GMT 2025
PRIMARY
FDA UNII
B7REK2R84C
Created by admin on Tue Apr 01 16:21:33 GMT 2025 , Edited by admin on Tue Apr 01 16:21:33 GMT 2025
PRIMARY
PUBCHEM
6452867
Created by admin on Tue Apr 01 16:21:33 GMT 2025 , Edited by admin on Tue Apr 01 16:21:33 GMT 2025
PRIMARY
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