3-methoxy-4-propan-2-yloxy-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)benzamide

Systemtic Name: 3-methoxy-4-propan-2-yloxy-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)benzamide Openeye Name: 4-isopropoxy-3-methoxy-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)benzamide CAS Name: 3-methoxy-4-propan-2-yloxy-N-[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]benzamide IUPAC Name: 3-methoxy-4-propan-2-yloxy-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)benzamide Traditional Name: 4-isopropoxy-3-methoxy-N-(6-pyrrolidinopyridin-1-ium-3-yl)benzamide Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NC2=C[NH+]=C(C=C2)N3CCCC3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NC2=C[NH+]=C(C=C2)N3CCCC3)OC

InChI

InChI=1S/C20H25N3O3/c1-14(2)26-17-8-6-15(12-18(17)25-3)20(24)22-16-7-9-19(21-13-16)23-10-4-5-11-23/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,22,24)/p+1