3-ethoxy-4-(pyridin-4-ylmethoxy)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzamide

Systemtic Name: 3-ethoxy-4-(pyridin-4-ylmethoxy)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzamide Openeye Name: 3-ethoxy-4-(4-pyridylmethoxy)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzamide CAS Name: 3-ethoxy-4-(pyridin-4-ylmethoxy)-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 3-ethoxy-4-(pyridin-4-ylmethoxy)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: 3-ethoxy-4-(4-pyridylmethoxy)-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]benzamide Formula: C25H29N4O3+ MolecularWeight: 433.52276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCCC3)OCC4=CC=NC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCCC3)OCC4=CC=NC=C4

InChI

InChI=1S/C25H28N4O3/c1-2-31-23-15-21(6-7-22(23)32-18-19-9-11-26-12-10-19)25(30)28-17-20-5-8-24(27-16-20)29-13-3-4-14-29/h5-12,15-16H,2-4,13-14,17-18H2,1H3,(H,28,30)/p+1