N-[4-[3-cyano-4-(dimethylamino)pyridin-1-ium-2-yl]oxyphenyl]ethanamide

Systemtic Name: N-[4-[3-cyano-4-(dimethylamino)pyridin-1-ium-2-yl]oxyphenyl]ethanamide Openeye Name: N-[4-[3-cyano-4-(dimethylamino)pyridin-1-ium-2-yl]oxyphenyl]acetamide CAS Name: N-[4-[[3-cyano-4-(dimethylamino)-2-pyridin-1-iumyl]oxy]phenyl]acetamide IUPAC Name: N-[4-[3-cyano-4-(dimethylamino)pyridin-1-ium-2-yl]oxyphenyl]acetamide Traditional Name: N-[4-[3-cyano-4-(dimethylamino)pyridin-1-ium-2-yl]oxyphenyl]acetamide Formula: C16H17N4O2+ MolecularWeight: 297.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC2=[NH+]C=CC(=C2C#N)N(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC2=[NH+]C=CC(=C2C#N)N(C)C

InChI

InChI=1S/C16H16N4O2/c1-11(21)19-12-4-6-13(7-5-12)22-16-14(10-17)15(20(2)3)8-9-18-16/h4-9H,1-3H3,(H,19,21)/p+1