ethyl (E)-2-cyano-3-[3-oxidanylidene-2-[2-oxidanylidene-2-(2-phenoxyethoxy)ethyl]piperazin-1-yl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[3-oxidanylidene-2-[2-oxidanylidene-2-(2-phenoxyethoxy)ethyl]piperazin-1-yl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[3-oxo-2-[2-oxo-2-(2-phenoxyethoxy)ethyl]piperazin-1-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-oxo-2-[2-oxo-2-(2-phenoxyethoxy)ethyl]-1-piperazinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[3-oxo-2-[2-oxo-2-(2-phenoxyethoxy)ethyl]piperazin-1-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-keto-2-[2-keto-2-(2-phenoxyethoxy)ethyl]piperazino]acrylic acid ethyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CCNC(=O)C1CC(=O)OCCOC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/N1CCNC(=O)C1CC(=O)OCCOC2=CC=CC=C2)/C#N

InChI

InChI=1S/C20H23N3O6/c1-2-27-20(26)15(13-21)14-23-9-8-22-19(25)17(23)12-18(24)29-11-10-28-16-6-4-3-5-7-16/h3-7,14,17H,2,8-12H2,1H3,(H,22,25)/b15-14+