5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 3-(4-acetyloxyphenyl)propanoate

Systemtic Name: 5-[3,5-bis(oxidanylidene)piperazin-1-yl]pentyl 3-(4-acetyloxyphenyl)propanoate Openeye Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 3-(4-acetoxyphenyl)propanoate CAS Name: 3-(4-acetyloxyphenyl)propanoic acid 5-(3,5-dioxo-1-piperazinyl)pentyl ester IUPAC Name: 5-(3,5-dioxopiperazin-1-yl)pentyl 3-(4-acetyloxyphenyl)propanoate Traditional Name: 3-(4-acetoxyphenyl)propionic acid 5-(3,5-diketopiperazino)pentyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)CCC(=O)OCCCCCN2CC(=O)NC(=O)C2

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)CCC(=O)OCCCCCN2CC(=O)NC(=O)C2

InChI

InChI=1S/C20H26N2O6/c1-15(23)28-17-8-5-16(6-9-17)7-10-20(26)27-12-4-2-3-11-22-13-18(24)21-19(25)14-22/h5-6,8-9H,2-4,7,10-14H2,1H3,(H,21,24,25)