4-propan-2-yloxy-N-(pyridin-1-ium-3-ylmethyl)benzamide

Systemtic Name: 4-propan-2-yloxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Openeye Name: 4-isopropoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide CAS Name: 4-propan-2-yloxy-N-(3-pyridin-1-iumylmethyl)benzamide IUPAC Name: 4-propan-2-yloxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Traditional Name: 4-isopropoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NCC2=C[NH+]=CC=C2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NCC2=C[NH+]=CC=C2

InChI

InChI=1S/C16H18N2O2/c1-12(2)20-15-7-5-14(6-8-15)16(19)18-11-13-4-3-9-17-10-13/h3-10,12H,11H2,1-2H3,(H,18,19)/p+1