N-(3-cyano-4,5-dimethyl-furan-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-furan-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(3-cyano-4,5-dimethyl-2-furanyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(3-cyano-4,5-dimethylfuran-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-furyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C18H20N3O2+ MolecularWeight: 310.3703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=C(OC(=C1C#N)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C18H19N3O2/c1-12-13(2)23-18(16(12)9-19)20-17(22)11-21-8-7-14-5-3-4-6-15(14)10-21/h3-6H,7-8,10-11H2,1-2H3,(H,20,22)/p+1