N-[(2-chlorophenyl)methyl]-2-oxidanylidene-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-oxidanylidene-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-keto-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1H-pyridine-3-carboxamide Formula: C23H23ClN3O2+ MolecularWeight: 408.90062

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C(=O)N3)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C(=O)N3)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C23H22ClN3O2/c24-21-8-4-3-6-17(21)13-25-22(28)20-10-9-19(26-23(20)29)15-27-12-11-16-5-1-2-7-18(16)14-27/h1-10H,11-15H2,(H,25,28)(H,26,29)/p+1