3,4-diethoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide

Systemtic Name: 3,4-diethoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Openeye Name: 3,4-diethoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide CAS Name: 3,4-diethoxy-N-(3-pyridin-1-iumylmethyl)benzamide IUPAC Name: 3,4-diethoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Traditional Name: 3,4-diethoxy-N-(pyridin-1-ium-3-ylmethyl)benzamide Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC2=C[NH+]=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC2=C[NH+]=CC=C2)OCC

InChI

InChI=1S/C17H20N2O3/c1-3-21-15-8-7-14(10-16(15)22-4-2)17(20)19-12-13-6-5-9-18-11-13/h5-11H,3-4,12H2,1-2H3,(H,19,20)/p+1