[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(1-methylindol-3-yl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(1-methylindol-3-yl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(1-methylindol-3-yl)methyl]-(4-pyridylmethyl)ammonium CAS Name: [1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl-[(1-methyl-3-indolyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(1-methylindol-3-yl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(1-methylindol-3-yl)methyl]-(4-pyridylmethyl)ammonium Formula: C25H36N4O+2 MolecularWeight: 408.57954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C[NH+](CC3CC[NH+](CC3)CCOC)CC4=CC=NC=C4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[NH+](CC3CC[NH+](CC3)CCOC)CC4=CC=NC=C4

InChI

InChI=1S/C25H34N4O/c1-27-19-23(24-5-3-4-6-25(24)27)20-29(17-21-7-11-26-12-8-21)18-22-9-13-28(14-10-22)15-16-30-2/h3-8,11-12,19,22H,9-10,13-18,20H2,1-2H3/p+2