6-methyl-1-[(2-propan-2-yloxyphenyl)methyl]-4-quinolin-2-yl-4H-pyridine-3-carboxylic acid

Systemtic Name: 6-methyl-1-[(2-propan-2-yloxyphenyl)methyl]-4-quinolin-2-yl-4H-pyridine-3-carboxylic acid Openeye Name: 1-[(2-isopropoxyphenyl)methyl]-6-methyl-4-(2-quinolyl)-4H-pyridine-3-carboxylic acid CAS Name: 6-methyl-1-[(2-propan-2-yloxyphenyl)methyl]-4-(2-quinolinyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 6-methyl-1-[(2-propan-2-yloxyphenyl)methyl]-4-quinolin-2-yl-4H-pyridine-3-carboxylic acid Traditional Name: 1-(2-isopropoxybenzyl)-6-methyl-4-(2-quinolyl)-4H-pyridine-3-carboxylic acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(=CN1CC2=CC=CC=C2OC(C)C)C(=O)O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(C(=CN1CC2=CC=CC=C2OC(C)C)C(=O)O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H26N2O3/c1-17(2)31-25-11-7-5-9-20(25)15-28-16-22(26(29)30)21(14-18(28)3)24-13-12-19-8-4-6-10-23(19)27-24/h4-14,16-17,21H,15H2,1-3H3,(H,29,30)