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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H19NO2.ClH
Molecular Weight 245.746
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

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

SMILES

Cl.CCCCNC[C@@H](O)C1=CC=C(O)C=C1

InChI

InChIKey=PDVPUUWBYQMKHW-UTONKHPSSA-N
InChI=1S/C12H19NO2.ClH/c1-2-3-8-13-9-12(15)10-4-6-11(14)7-5-10;/h4-7,12-15H,2-3,8-9H2,1H3;1H/t12-;/m1./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 C12H19NO2
Molecular Weight 209.2848
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 Sat Dec 16 09:03:27 UTC 2023
Edited
by admin
on Sat Dec 16 09:03:27 UTC 2023
Record UNII
1520CZ8T5P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BAMETHAN HYDROCHLORIDE, (S)-
Common Name English
BENZENEMETHANOL, .ALPHA.-((BUTYLAMINO)METHYL)-4-HYDROXY-, HYDROCHLORIDE (1:1), (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
1520CZ8T5P
Created by admin on Sat Dec 16 09:03:27 UTC 2023 , Edited by admin on Sat Dec 16 09:03:27 UTC 2023
PRIMARY
PUBCHEM
76964391
Created by admin on Sat Dec 16 09:03:27 UTC 2023 , Edited by admin on Sat Dec 16 09:03:27 UTC 2023
PRIMARY
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