1-[3-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]prop-2-ynyl]piperidine

Systemtic Name: 1-[3-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]prop-2-ynyl]piperidine Openeye Name: 1-[3-[4-[4-[3-(1-piperidyl)propoxy]phenyl]phenyl]prop-2-ynyl]piperidine CAS Name: 1-[3-[4-[4-[3-(1-piperidinyl)propoxy]phenyl]phenyl]prop-2-ynyl]piperidine IUPAC Name: 1-[3-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]prop-2-ynyl]piperidine Traditional Name: 1-[3-[4-[4-(3-piperidinopropoxy)phenyl]phenyl]prop-2-ynyl]piperidine Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#CCN4CCCCC4

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#CCN4CCCCC4

InChI

InChI=1S/C28H36N2O/c1-3-18-29(19-4-1)22-7-9-25-10-12-26(13-11-25)27-14-16-28(17-15-27)31-24-8-23-30-20-5-2-6-21-30/h10-17H,1-6,8,18-24H2