2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-5-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-5-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-2-ylmethyl)azanium Openeye Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-5-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(2-pyridylmethyl)ammonium CAS Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(5-quinoxalinylmethyl)-4-piperidin-1-iumyl]ethyl]-(2-pyridinylmethyl)ammonium IUPAC Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-5-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(pyridin-2-ylmethyl)azanium Traditional Name: 2-methoxyethyl-[(1R)-2-phenyl-1-[1-(quinoxalin-5-ylmethyl)piperidin-1-ium-4-yl]ethyl]-(2-pyridylmethyl)ammonium Formula: C31H39N5O+2 MolecularWeight: 497.67426

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=CC=CC=N1)C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=C5C(=CC=C4)N=CC=N5

Isomeric SMILES

COCC[NH+](CC1=CC=CC=N1)[C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=C5C(=CC=C4)N=CC=N5

InChI

InChI=1S/C31H37N5O/c1-37-21-20-36(24-28-11-5-6-15-32-28)30(22-25-8-3-2-4-9-25)26-13-18-35(19-14-26)23-27-10-7-12-29-31(27)34-17-16-33-29/h2-12,15-17,26,30H,13-14,18-24H2,1H3/p+2/t30-/m1/s1