2-methoxyethyl-[(1S)-2-phenyl-1-(1-propylpiperidin-1-ium-4-yl)ethyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: 2-methoxyethyl-[(1S)-2-phenyl-1-(1-propylpiperidin-1-ium-4-yl)ethyl]-(pyridin-2-ylmethyl)azanium Openeye Name: 2-methoxyethyl-[(1S)-2-phenyl-1-(1-propylpiperidin-1-ium-4-yl)ethyl]-(2-pyridylmethyl)ammonium CAS Name: 2-methoxyethyl-[(1S)-2-phenyl-1-(1-propyl-4-piperidin-1-iumyl)ethyl]-(2-pyridinylmethyl)ammonium IUPAC Name: 2-methoxyethyl-[(1S)-2-phenyl-1-(1-propylpiperidin-1-ium-4-yl)ethyl]-(pyridin-2-ylmethyl)azanium Traditional Name: 2-methoxyethyl-[(1S)-2-phenyl-1-(1-propylpiperidin-1-ium-4-yl)ethyl]-(2-pyridylmethyl)ammonium Formula: C25H39N3O+2 MolecularWeight: 397.59666

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)C(CC2=CC=CC=C2)[NH+](CCOC)CC3=CC=CC=N3

Isomeric SMILES

CCC[NH+]1CCC(CC1)[C@H](CC2=CC=CC=C2)[NH+](CCOC)CC3=CC=CC=N3

InChI

InChI=1S/C25H37N3O/c1-3-15-27-16-12-23(13-17-27)25(20-22-9-5-4-6-10-22)28(18-19-29-2)21-24-11-7-8-14-26-24/h4-11,14,23,25H,3,12-13,15-21H2,1-2H3/p+2/t25-/m0/s1