2,6-dimethyl-1-(phenylmethyl)-4-thiophen-2-yl-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-1-(phenylmethyl)-4-thiophen-2-yl-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 1-benzyl-2,6-dimethyl-4-(2-thienyl)-4H-pyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-1-(phenylmethyl)-4-thiophen-2-yl-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 1-benzyl-2,6-dimethyl-4-thiophen-2-yl-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 1-benzyl-2,6-dimethyl-4-(2-thienyl)-4H-pyridine-3,5-dicarboxylic acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CC2=CC=CC=C2)C)C(=O)O)C3=CC=CS3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1CC2=CC=CC=C2)C)C(=O)O)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C20H19NO4S/c1-12-16(19(22)23)18(15-9-6-10-26-15)17(20(24)25)13(2)21(12)11-14-7-4-3-5-8-14/h3-10,18H,11H2,1-2H3,(H,22,23)(H,24,25)