6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxylic acid Openeye Name: 6-[[1,2,2-tris(2-pyridyl)ethylamino]methyl]pyridine-3-carboxylic acid CAS Name: 6-[[1,2,2-tris(2-pyridinyl)ethylamino]methyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxylic acid Traditional Name: 6-[[1,2,2-tris(2-pyridyl)ethylamino]methyl]nicotinic acid Formula: C24H21N5O2 MolecularWeight: 411.45584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(C2=CC=CC=N2)C(C3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C(C2=CC=CC=N2)C(C3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H21N5O2/c30-24(31)17-10-11-18(28-15-17)16-29-23(21-9-3-6-14-27-21)22(19-7-1-4-12-25-19)20-8-2-5-13-26-20/h1-15,22-23,29H,16H2,(H,30,31)