(1-cyclopentylpiperidin-1-ium-4-yl)methyl-(pyridin-3-ylmethyl)-(quinolin-4-ylmethyl)azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-(pyridin-3-ylmethyl)-(quinolin-4-ylmethyl)azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-(3-pyridylmethyl)-(4-quinolylmethyl)ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-(3-pyridinylmethyl)-(4-quinolinylmethyl)ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-(pyridin-3-ylmethyl)-(quinolin-4-ylmethyl)azanium Traditional Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-(3-pyridylmethyl)-(4-quinolylmethyl)ammonium Formula: C27H36N4+2 MolecularWeight: 416.60154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=CC=NC5=CC=CC=C45

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C27H34N4/c1-2-8-25(7-1)31-16-12-22(13-17-31)19-30(20-23-6-5-14-28-18-23)21-24-11-15-29-27-10-4-3-9-26(24)27/h3-6,9-11,14-15,18,22,25H,1-2,7-8,12-13,16-17,19-21H2/p+2