N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-4-carboxamide Openeye Name: N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-4-carboxamide CAS Name: N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-4-pyridinecarboxamide IUPAC Name: N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-4-carboxamide Traditional Name: N-[2-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]isonicotinamide Formula: C22H26N5O+ MolecularWeight: 376.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

CCC1=NC(=C(N1)C)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H25N5O/c1-3-21-24-15(2)20(26-21)14-27-11-8-16-4-5-19(12-18(16)13-27)25-22(28)17-6-9-23-10-7-17/h4-7,9-10,12H,3,8,11,13-14H2,1-2H3,(H,24,26)(H,25,28)/p+1