phenethyl 4-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[2-(2-decoxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[2-(2-decoxy-2-oxoethyl)-3-oxo-1-piperazinyl]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-(2-decoxy-2-oxoethyl)-3-oxopiperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[2-(2-decoxy-2-keto-ethyl)-3-keto-piperazino]-4-keto-butyric acid phenethyl ester Formula: C28H42N2O6 MolecularWeight: 502.64288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C28H42N2O6/c1-2-3-4-5-6-7-8-12-20-35-27(33)22-24-28(34)29-18-19-30(24)25(31)15-16-26(32)36-21-17-23-13-10-9-11-14-23/h9-11,13-14,24H,2-8,12,15-22H2,1H3,(H,29,34)