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

Details

Stereochemistry RACEMIC
Molecular Formula C14H23NO3
Molecular Weight 253.3373
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3C-P

SMILES

CCCOC1=C(OC)C=C(CC(C)N)C=C1OC

InChI

InChIKey=KKMCHCCXGKYEKJ-UHFFFAOYSA-N
InChI=1S/C14H23NO3/c1-5-6-18-14-12(16-3)8-11(7-10(2)15)9-13(14)17-4/h8-10H,5-7,15H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C14H23NO3
Molecular Weight 253.3373
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
4KRX4MHV7L
Record Status Validated (UNII)
Record Version