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Details

Stereochemistry RACEMIC
Molecular Formula C14H21N3O2
Molecular Weight 263.3354
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESOXYMANSIL

SMILES

CC(C)NCC1CCC2=C(N1)C=C(C(C)=C2)[N+]([O-])=O

InChI

InChIKey=XRDXINBBVUAHGQ-UHFFFAOYSA-N
InChI=1S/C14H21N3O2/c1-9(2)15-8-12-5-4-11-6-10(3)14(17(18)19)7-13(11)16-12/h6-7,9,12,15-16H,4-5,8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C14H21N3O2
Molecular Weight 263.3354
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
The metabolism of a new schistosomicide 2-isopropylaminomethyl-6-methyl-7-nitro-1,2,3,4-tetrahydroquinoline (UK 3883).
1972 Mar
Substance Class Chemical
Created
by admin
on Sat Dec 16 14:00:07 GMT 2023
Edited
by admin
on Sat Dec 16 14:00:07 GMT 2023
Record UNII
G2455WQ2J3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESOXYMANSIL
Common Name English
UK 3883
Code English
QUINOLINE, 1,2,3,4-TETRAHYDRO-2-((ISOPROPYLAMINO)METHYL)-6-METHYL-7-NITRO-
Systematic Name English
2-ISOPROPYLAMINOMETHYL-6-METHYL-7-NITRO-1,2,3,4-TETRAHYDROQUINOLINE
Systematic Name English
1,2,3,4-TETRAHYDRO-2-((ISOPROPYLAMINO)METHYL)-6-METHYL-7-NITROQUINOLINE
Systematic Name English
Code System Code Type Description
CAS
21738-41-0
Created by admin on Sat Dec 16 14:00:07 GMT 2023 , Edited by admin on Sat Dec 16 14:00:07 GMT 2023
PRIMARY
FDA UNII
G2455WQ2J3
Created by admin on Sat Dec 16 14:00:07 GMT 2023 , Edited by admin on Sat Dec 16 14:00:07 GMT 2023
PRIMARY
PUBCHEM
161370
Created by admin on Sat Dec 16 14:00:07 GMT 2023 , Edited by admin on Sat Dec 16 14:00:07 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE