[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-(4-pyridylmethyl)ammonium CAS Name: [1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(5-methyl-1-propylpyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-(4-pyridylmethyl)ammonium Formula: C23H39N5O+2 MolecularWeight: 401.58866

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3)C

InChI

InChI=1S/C23H37N5O/c1-4-11-28-20(2)23(16-25-28)19-27(17-21-5-9-24-10-6-21)18-22-7-12-26(13-8-22)14-15-29-3/h5-6,9-10,16,22H,4,7-8,11-15,17-19H2,1-3H3/p+2