(6-chloranylquinolin-2-yl)methyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: (6-chloranylquinolin-2-yl)methyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: (6-chloro-2-quinolyl)methyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-(3-pyridylmethyl)ammonium CAS Name: (6-chloro-2-quinolinyl)methyl-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: (6-chloroquinolin-2-yl)methyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: (6-chloro-2-quinolyl)methyl-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-(3-pyridylmethyl)ammonium Formula: C27H35ClN4+2 MolecularWeight: 451.0466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=NC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=NC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C27H33ClN4/c28-24-8-10-27-23(16-24)7-9-25(30-27)20-31(19-22-4-3-13-29-17-22)18-21-11-14-32(15-12-21)26-5-1-2-6-26/h3-4,7-10,13,16-17,21,26H,1-2,5-6,11-12,14-15,18-20H2/p+2