8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: 8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylate Openeye Name: 8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylate CAS Name: 8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-2-imidazo[1,2-a]pyridinecarboxylate IUPAC Name: 8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 8-methyl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylate Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2C[NH+]3CCC4=CC=CC=C4C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2C[NH+]3CCC4=CC=CC=C4C3)C(=O)[O-]

InChI

InChI=1S/C19H19N3O2/c1-13-5-4-9-22-16(17(19(23)24)20-18(13)22)12-21-10-8-14-6-2-3-7-15(14)11-21/h2-7,9H,8,10-12H2,1H3,(H,23,24)