N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]propanamide

Systemtic Name: N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]propanamide Openeye Name: N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]propanamide CAS Name: N-[2-[(3-cyano-7-methyl-2-quinolin-1-iumyl)amino]ethyl]propanamide IUPAC Name: N-[2-[(3-cyano-7-methylquinolin-1-ium-2-yl)amino]ethyl]propanamide Traditional Name: N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]propionamide Formula: C16H19N4O+ MolecularWeight: 283.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCNC1=[NH+]C2=C(C=CC(=C2)C)C=C1C#N

Isomeric SMILES

CCC(=O)NCCNC1=[NH+]C2=C(C=CC(=C2)C)C=C1C#N

InChI

InChI=1S/C16H18N4O/c1-3-15(21)18-6-7-19-16-13(10-17)9-12-5-4-11(2)8-14(12)20-16/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,21)(H,19,20)/p+1