1-[[1-[4-(pyrrolidin-1-ylmethyl)phenyl]piperidin-4-yl]methyl]-1-azacyclotridecane

Systemtic Name: 1-[[1-[4-(pyrrolidin-1-ylmethyl)phenyl]piperidin-4-yl]methyl]-1-azacyclotridecane Openeye Name: 1-[[1-[4-(pyrrolidin-1-ylmethyl)phenyl]-4-piperidyl]methyl]-azacyclotridecane CAS Name: 1-[[1-[4-(1-pyrrolidinylmethyl)phenyl]-4-piperidinyl]methyl]-azacyclotridecane IUPAC Name: 1-[[1-[4-(pyrrolidin-1-ylmethyl)phenyl]piperidin-4-yl]methyl]-azacyclotridecane Traditional Name: 1-[[1-[4-(pyrrolidinomethyl)phenyl]-4-piperidyl]methyl]-azacyclotridecane Formula: C29H49N3 MolecularWeight: 439.71946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCN(CCCCC1)CC2CCN(CC2)C3=CC=C(C=C3)CN4CCCC4

Isomeric SMILES

C1CCCCCCN(CCCCC1)CC2CCN(CC2)C3=CC=C(C=C3)CN4CCCC4

InChI

InChI=1S/C29H49N3/c1-2-4-6-8-10-20-30(19-9-7-5-3-1)26-28-17-23-32(24-18-28)29-15-13-27(14-16-29)25-31-21-11-12-22-31/h13-16,28H,1-12,17-26H2