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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCN(CCCCC1)CC2=CC=C(C=C2)N3CCC(CC3)CN4CCCC4

Isomeric SMILES

C1CCCCCCN(CCCCC1)CC2=CC=C(C=C2)N3CCC(CC3)CN4CCCC4

InChI

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