1-phenyl-4-[5-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine

Systemtic Name: 1-phenyl-4-[5-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine Openeye Name: 1-phenyl-4-[5-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine CAS Name: 1-phenyl-4-[5-[3-(1-pyrrolidinylmethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine IUPAC Name: 1-phenyl-4-[5-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine Traditional Name: 1-phenyl-4-[5-[3-(pyrrolidinomethyl)phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]piperazine Formula: C29H39N3 MolecularWeight: 429.64006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC(=C2)C3CC4CC(CC4C3)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CC2=CC=CC(=C2)C3CC4CC(CC4C3)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C29H39N3/c1-2-9-28(10-3-1)31-13-15-32(16-14-31)29-20-26-18-25(19-27(26)21-29)24-8-6-7-23(17-24)22-30-11-4-5-12-30/h1-3,6-10,17,25-27,29H,4-5,11-16,18-22H2