5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 2-phenylpropanoate

Systemtic Name: 5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 2-phenylpropanoate Openeye Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 2-phenylpropanoate CAS Name: 2-phenylpropanoic acid 5-(3,5-dioxo-1-piperazinyl)pentyl ester IUPAC Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 2-phenylpropanoate Traditional Name: 2-phenylpropionic acid 5-(3,5-diketopiperazino)pentyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)OCCCCCN2CC(=O)NC(=O)C2

Isomeric SMILES

CC(C1=CC=CC=C1)C(=O)OCCCCCN2CC(=O)NC(=O)C2

InChI

InChI=1S/C18H24N2O4/c1-14(15-8-4-2-5-9-15)18(23)24-11-7-3-6-10-20-12-16(21)19-17(22)13-20/h2,4-5,8-9,14H,3,6-7,10-13H2,1H3,(H,19,21,22)