2-[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate

Systemtic Name: 2-[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate Openeye Name: 2-[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]-1-piperazinyl]-oxomethyl]-1-pyrrolidinecarboxylate IUPAC Name: 2-[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Traditional Name: 2-[4-[3-[4-(4-cyanophenyl)phenoxy]propyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Formula: C26H29N4O4- MolecularWeight: 461.53286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)[O-])C(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)[O-])C(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H30N4O4/c27-19-20-4-6-21(7-5-20)22-8-10-23(11-9-22)34-18-2-12-28-14-16-29(17-15-28)25(31)24-3-1-13-30(24)26(32)33/h4-11,24H,1-3,12-18H2,(H,32,33)/p-1