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

Details

Stereochemistry RACEMIC
Molecular Formula C16H19N3O3
Molecular Weight 301.3404
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HIOC

SMILES

OC1=CC=C2NC=C(CCNC(=O)C3CCCNC3=O)C2=C1

InChI

InChIKey=ZIMKJLALTRLXJO-UHFFFAOYSA-N
InChI=1S/C16H19N3O3/c20-11-3-4-14-13(8-11)10(9-19-14)5-7-18-16(22)12-2-1-6-17-15(12)21/h3-4,8-9,12,19-20H,1-2,5-7H2,(H,17,21)(H,18,22)

HIDE SMILES / InChI

Molecular Formula C16H19N3O3
Molecular Weight 301.3404
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

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Record UNII
JC3KZQ72GW
Record Status Validated (UNII)
Record Version