ethyl 2-cyano-3-[4-[2-cyano-3-ethoxy-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]piperazin-1-yl]-3-(4-methoxyphenyl)propanoate

Systemtic Name: ethyl 2-cyano-3-[4-[2-cyano-3-ethoxy-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]piperazin-1-yl]-3-(4-methoxyphenyl)propanoate Openeye Name: ethyl 2-cyano-3-[4-[2-cyano-3-ethoxy-1-(4-methoxyphenyl)-3-oxo-propyl]piperazin-1-yl]-3-(4-methoxyphenyl)propanoate CAS Name: 2-cyano-3-[4-[2-cyano-3-ethoxy-1-(4-methoxyphenyl)-3-oxopropyl]-1-piperazinyl]-3-(4-methoxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[4-[2-cyano-3-ethoxy-1-(4-methoxyphenyl)-3-oxopropyl]piperazin-1-yl]-3-(4-methoxyphenyl)propanoate Traditional Name: 2-cyano-3-[4-[2-cyano-3-ethoxy-3-keto-1-(4-methoxyphenyl)propyl]piperazino]-3-(4-methoxyphenyl)propionic acid ethyl ester Formula: C30H36N4O6 MolecularWeight: 548.63004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C1=CC=C(C=C1)OC)N2CCN(CC2)C(C3=CC=C(C=C3)OC)C(C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C#N)C(C1=CC=C(C=C1)OC)N2CCN(CC2)C(C3=CC=C(C=C3)OC)C(C#N)C(=O)OCC

InChI

InChI=1S/C30H36N4O6/c1-5-39-29(35)25(19-31)27(21-7-11-23(37-3)12-8-21)33-15-17-34(18-16-33)28(26(20-32)30(36)40-6-2)22-9-13-24(38-4)14-10-22/h7-14,25-28H,5-6,15-18H2,1-4H3