U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C23H32N2O6
Molecular Weight 432.51
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of Methyl 1-(3-methoxy-3-oxopropyl)-4-[(2-methyl-3-oxopentanoyl)(phenyl)amino]piperidine-4-carboxylate

SMILES

CCC(=O)C(C)C(=O)N(C1=CC=CC=C1)C2(CCN(CCC(=O)OC)CC2)C(=O)OC

InChI

InChIKey=GTCJEIDBPVRZJI-UHFFFAOYSA-N
InChI=1S/C23H32N2O6/c1-5-19(26)17(2)21(28)25(18-9-7-6-8-10-18)23(22(29)31-4)12-15-24(16-13-23)14-11-20(27)30-3/h6-10,17H,5,11-16H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C23H32N2O6
Molecular Weight 432.51
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
8EF3J5FHK8
Record Status Validated (UNII)
Record Version