ethyl 3-[3,6-bis(oxidanylidene)-4-(phenylmethyl)piperazin-2-yl]propanoate

Systemtic Name: ethyl 3-[3,6-bis(oxidanylidene)-4-(phenylmethyl)piperazin-2-yl]propanoate Openeye Name: ethyl 3-(4-benzyl-3,6-dioxo-piperazin-2-yl)propanoate CAS Name: 3-[3,6-dioxo-4-(phenylmethyl)-2-piperazinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-benzyl-3,6-dioxopiperazin-2-yl)propanoate Traditional Name: 3-(4-benzyl-3,6-diketo-piperazin-2-yl)propionic acid ethyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1C(=O)N(CC(=O)N1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCC1C(=O)N(CC(=O)N1)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O4/c1-2-22-15(20)9-8-13-16(21)18(11-14(19)17-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,17,19)