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Details

Stereochemistry RACEMIC
Molecular Formula C20H28NO4
Molecular Weight 346.4406
Optical Activity ( + / - )
Defined Stereocenters 3 / 5
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of TEMATROPIUM

SMILES

CCOC(=O)C(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)C3=CC=CC=C3

InChI

InChIKey=KUUJTAUBFSBFAA-KCUXLOIUSA-N
InChI=1S/C20H28NO4/c1-4-24-19(22)18(14-8-6-5-7-9-14)20(23)25-17-12-15-10-11-16(13-17)21(15,2)3/h5-9,15-18H,4,10-13H2,1-3H3/q+1/t15-,16+,17+,18?

HIDE SMILES / InChI

Molecular Formula C20H28NO4
Molecular Weight 346.4406
Charge 1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 3 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

Tematropium, a muscarinic acetylcholine receptor antagonist that was studied as an antiasthmatic agent. Information about the current use of this compound is not available.

Approval Year

Substance Class Chemical
Record UNII
6P0T83L90T
Record Status Validated (UNII)
Record Version