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

Details

Stereochemistry RACEMIC
Molecular Formula C10H17N3O
Molecular Weight 195.2615
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N′-Propyl-4,5,6,7-tetrahydrobenzo[d][1,3]oxazole-2,6-diamine

SMILES

CCCNC1CCC2=C(C1)OC(N)=N2

InChI

InChIKey=MQRYSFGCTQQCHZ-UHFFFAOYSA-N
InChI=1S/C10H17N3O/c1-2-5-12-7-3-4-8-9(6-7)14-10(11)13-8/h7,12H,2-6H2,1H3,(H2,11,13)

HIDE SMILES / InChI

Molecular Formula C10H17N3O
Molecular Weight 195.2615
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
43NK8TL2NP
Record Status Validated (UNII)
Record Version