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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H48N2O10.2ClH
Molecular Weight 693.653
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTOBENDINE DIHYDROCHLORIDE

SMILES

Cl.Cl.CC[C@@H](COC(=O)C1=CC(OC)=C(OC)C(OC)=C1)N(C)CCN(C)[C@@H](CC)COC(=O)C2=CC(OC)=C(OC)C(OC)=C2

InChI

InChIKey=NNSPSTCLUNWYSE-WLKYSPGFSA-N
InChI=1S/C32H48N2O10.2ClH/c1-11-23(19-43-31(35)21-15-25(37-5)29(41-9)26(16-21)38-6)33(3)13-14-34(4)24(12-2)20-44-32(36)22-17-27(39-7)30(42-10)28(18-22)40-8;;/h15-18,23-24H,11-14,19-20H2,1-10H3;2*1H/t23-,24-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula C32H48N2O10
Molecular Weight 620.7309
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

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

PubMed

PubMed

TitleDatePubMed
Determination of some cardiac drugs using an ionselective chloride electrode and a silver electrode.
1985 Jun
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:31:59 GMT 2023
Edited
by admin
on Sat Dec 16 18:31:59 GMT 2023
Record UNII
3OXO5I6B0G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTOBENDINE DIHYDROCHLORIDE
MI  
Common Name English
BUTOBENDIN HYDROCHLORIDE
Common Name English
CRAVITEN
Brand Name English
BUTOBENDINE HYDROCHLORIDE
Common Name English
M-71
Code English
BUTOBENDINE DIHYDROCHLORIDE [MI]
Common Name English
BENZOIC ACID, 3,4,5-TRIMETHOXY-, 1,2-ETHANEDIYLBIS((METHYLIMINO)((2S)-2-ETHYL-2,1-ETHANEDIYL)) ESTER, DIHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
16072177
Created by admin on Sat Dec 16 18:31:59 GMT 2023 , Edited by admin on Sat Dec 16 18:31:59 GMT 2023
PRIMARY
MERCK INDEX
m605
Created by admin on Sat Dec 16 18:31:59 GMT 2023 , Edited by admin on Sat Dec 16 18:31:59 GMT 2023
PRIMARY Merck Index
FDA UNII
3OXO5I6B0G
Created by admin on Sat Dec 16 18:31:59 GMT 2023 , Edited by admin on Sat Dec 16 18:31:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID00204329
Created by admin on Sat Dec 16 18:31:59 GMT 2023 , Edited by admin on Sat Dec 16 18:31:59 GMT 2023
PRIMARY
CAS
55769-64-7
Created by admin on Sat Dec 16 18:31:59 GMT 2023 , Edited by admin on Sat Dec 16 18:31:59 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY