2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-6-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-6-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-6-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(3-pyridylmethyl)ammonium CAS Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(6-quinoxalinylmethyl)-4-piperidin-1-iumyl]ethyl]-(3-pyridinylmethyl)ammonium IUPAC Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-6-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-6-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(3-pyridylmethyl)ammonium Formula: C31H39N5O+2 MolecularWeight: 497.67426

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=CN=CC=C1)C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC5=NC=CN=C5C=C4

Isomeric SMILES

COCC[NH+](CC1=CN=CC=C1)[C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C31H37N5O/c1-37-19-18-36(24-27-8-5-13-32-22-27)31(21-25-6-3-2-4-7-25)28-11-16-35(17-12-28)23-26-9-10-29-30(20-26)34-15-14-33-29/h2-10,13-15,20,22,28,31H,11-12,16-19,21,23-24H2,1H3/p+2/t31-/m1/s1