2-[3-bromanyl-5-cyano-4-(methoxymethyl)-2-methyl-6-oxidanylidene-pyridin-1-yl]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide

Systemtic Name: 2-[3-bromanyl-5-cyano-4-(methoxymethyl)-2-methyl-6-oxidanylidene-pyridin-1-yl]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide Openeye Name: 2-[3-bromo-5-cyano-4-(methoxymethyl)-2-methyl-6-oxo-1-pyridyl]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide CAS Name: 2-[3-bromo-5-cyano-4-(methoxymethyl)-2-methyl-6-oxo-1-pyridinyl]-N-[(1-methyl-4-piperidin-1-iumylidene)amino]acetamide IUPAC Name: 2-[3-bromo-5-cyano-4-(methoxymethyl)-2-methyl-6-oxopyridin-1-yl]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Traditional Name: 2-[5-bromo-3-cyano-2-keto-4-(methoxymethyl)-6-methyl-1-pyridyl]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Formula: C17H23BrN5O3+ MolecularWeight: 425.30022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=O)N1CC(=O)NN=C2CC[NH+](CC2)C)C#N)COC)Br

Isomeric SMILES

CC1=C(C(=C(C(=O)N1CC(=O)NN=C2CC[NH+](CC2)C)C#N)COC)Br

InChI

InChI=1S/C17H22BrN5O3/c1-11-16(18)14(10-26-3)13(8-19)17(25)23(11)9-15(24)21-20-12-4-6-22(2)7-5-12/h4-7,9-10H2,1-3H3,(H,21,24)/p+1