2-[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate

Systemtic Name: 2-[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate Openeye Name: 2-[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]-1-piperazinyl]-oxomethyl]-1-pyrrolidinecarboxylate IUPAC Name: 2-[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Traditional Name: 2-[4-[2-[4-(4-cyanophenyl)phenoxy]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Formula: C25H27N4O4- MolecularWeight: 447.50628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H28N4O4/c26-18-19-3-5-20(6-4-19)21-7-9-22(10-8-21)33-17-16-27-12-14-28(15-13-27)24(30)23-2-1-11-29(23)25(31)32/h3-10,23H,1-2,11-17H2,(H,31,32)/p-1