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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21N.ClH
Molecular Weight 275.816
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEMELVERINE HYDROCHLORIDE

SMILES

Cl.CN(CCC1=CC=CC=C1)CCC2=CC=CC=C2

InChI

InChIKey=WCOQXFHZJHKAGO-UHFFFAOYSA-N
InChI=1S/C17H21N.ClH/c1-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17;/h2-11H,12-15H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C17H21N
Molecular Weight 239.3553
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Demelverine is an antispasmodic agent and bronchodilator.

Approval Year

Substance Class Chemical
Record UNII
T568N7L7GE
Record Status Validated (UNII)
Record Version