N-[4-[6-azanyl-5-cyano-4-(2-methoxyphenyl)pyridin-1-ium-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[6-azanyl-5-cyano-4-(2-methoxyphenyl)pyridin-1-ium-2-yl]phenyl]ethanamide Openeye Name: N-[4-[6-amino-5-cyano-4-(2-methoxyphenyl)pyridin-1-ium-2-yl]phenyl]acetamide CAS Name: N-[4-[6-amino-5-cyano-4-(2-methoxyphenyl)-2-pyridin-1-iumyl]phenyl]acetamide IUPAC Name: N-[4-[6-amino-5-cyano-4-(2-methoxyphenyl)pyridin-1-ium-2-yl]phenyl]acetamide Traditional Name: N-[4-[6-amino-5-cyano-4-(2-methoxyphenyl)pyridin-1-ium-2-yl]phenyl]acetamide Formula: C21H19N4O2+ MolecularWeight: 359.40116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CC=C3OC)C#N)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CC=C3OC)C#N)N

InChI

InChI=1S/C21H18N4O2/c1-13(26)24-15-9-7-14(8-10-15)19-11-17(18(12-22)21(23)25-19)16-5-3-4-6-20(16)27-2/h3-11H,1-2H3,(H2,23,25)(H,24,26)/p+1