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Details

Stereochemistry ACHIRAL
Molecular Formula C21H23NO2
Molecular Weight 321.4128
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (11Z)-11-[3-(Dimethylamino)propylidene]-6,11-dihydrodibenz[b,e]oxepin-2-acetaldehyde

SMILES

CN(C)CC\C=C1\C2=CC=CC=C2COC3=CC=C(CC=O)C=C13

InChI

InChIKey=CTBUVTVWLYTOGO-UWVJOHFNSA-N
InChI=1S/C21H23NO2/c1-22(2)12-5-8-19-18-7-4-3-6-17(18)15-24-21-10-9-16(11-13-23)14-20(19)21/h3-4,6-10,13-14H,5,11-12,15H2,1-2H3/b19-8-

HIDE SMILES / InChI

Approval Year

Name Type Language
(Z)-2-(11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetaldehyde
Preferred Name English
(11Z)-11-[3-(Dimethylamino)propylidene]-6,11-dihydrodibenz[b,e]oxepin-2-acetaldehyde
Systematic Name English
Dibenz[b,e]oxepin-2-acetaldehyde, 11-[3-(dimethylamino)propylidene]-6,11-dihydro-, (11Z)-
Systematic Name English
2-[(11Z)-11-[3-(Dimethylamino)propylidene]-6H-benzo[c][1]benzoxepin-2-yl]acetaldehyde
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70728683
Created by admin on Wed Apr 02 17:44:22 GMT 2025 , Edited by admin on Wed Apr 02 17:44:22 GMT 2025
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CAS
1376615-97-2
Created by admin on Wed Apr 02 17:44:22 GMT 2025 , Edited by admin on Wed Apr 02 17:44:22 GMT 2025
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FDA UNII
PLH4365Y29
Created by admin on Wed Apr 02 17:44:22 GMT 2025 , Edited by admin on Wed Apr 02 17:44:22 GMT 2025
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PUBCHEM
58036923
Created by admin on Wed Apr 02 17:44:22 GMT 2025 , Edited by admin on Wed Apr 02 17:44:22 GMT 2025
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