U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H27N3
Molecular Weight 273.4164
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1H-Azepine, 1-((p-(diethylamino)benzylidene)amino)hexahydro-

SMILES

CCN(CC)C1=CC=C(C=C1)\C=N\N2CCCCCC2

InChI

InChIKey=DBJDUPSNGKBPPH-OBGWFSINSA-N
InChI=1S/C17H27N3/c1-3-19(4-2)17-11-9-16(10-12-17)15-18-20-13-7-5-6-8-14-20/h9-12,15H,3-8,13-14H2,1-2H3/b18-15+

HIDE SMILES / InChI

Approval Year

Name Type Language
1H-Azepine, 1-((p-(diethylamino)benzylidene)amino)hexahydro-
Systematic Name English
Hexamethylenimine, N-((p-(diethylamino)benzylidene)amino)-
Systematic Name English
N-[[4-(Diethylamino)phenyl]methylene]hexahydro-1H-azepin-1-amine
Systematic Name English
NSC-82821
Code English
Code System Code Type Description
PUBCHEM
9554397
Created by admin on Sat Dec 16 12:40:19 GMT 2023 , Edited by admin on Sat Dec 16 12:40:19 GMT 2023
PRIMARY
FDA UNII
A6VDE64ZX8
Created by admin on Sat Dec 16 12:40:19 GMT 2023 , Edited by admin on Sat Dec 16 12:40:19 GMT 2023
PRIMARY
NSC
82821
Created by admin on Sat Dec 16 12:40:19 GMT 2023 , Edited by admin on Sat Dec 16 12:40:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID50937695
Created by admin on Sat Dec 16 12:40:19 GMT 2023 , Edited by admin on Sat Dec 16 12:40:19 GMT 2023
PRIMARY
CAS
16987-28-3
Created by admin on Sat Dec 16 12:40:19 GMT 2023 , Edited by admin on Sat Dec 16 12:40:19 GMT 2023
PRIMARY