2-hydroxyethyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 2-hydroxyethyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-(3-pyridylmethyl)ammonium CAS Name: 2-hydroxyethyl-[[4-methoxy-3-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: 2-hydroxyethyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 2-hydroxyethyl-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-(3-pyridylmethyl)ammonium Formula: C21H31N3O2+2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+](CCO)CC2=CN=CC=C2)C[NH+]3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+](CCO)CC2=CN=CC=C2)C[NH+]3CCCC3

InChI

InChI=1S/C21H29N3O2/c1-26-21-7-6-18(13-20(21)17-23-9-2-3-10-23)15-24(11-12-25)16-19-5-4-8-22-14-19/h4-8,13-14,25H,2-3,9-12,15-17H2,1H3/p+2