2-[(2-methyl-6-propan-2-yl-phenyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2-methyl-6-propan-2-yl-phenyl)amino]pyridine-3-carboxylic acid Openeye Name: 2-(2-isopropyl-6-methyl-anilino)pyridine-3-carboxylic acid CAS Name: 2-(2-methyl-6-propan-2-ylanilino)-3-pyridinecarboxylic acid IUPAC Name: 2-(2-methyl-6-propan-2-ylanilino)pyridine-3-carboxylic acid Traditional Name: 2-(2-isopropyl-6-methyl-anilino)nicotinic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-10(2)12-7-4-6-11(3)14(12)18-15-13(16(19)20)8-5-9-17-15/h4-10H,1-3H3,(H,17,18)(H,19,20)