5-ethoxycarbonyl-2,4-diethyl-6-phenyl-pyridine-3-carboxylic acid

Systemtic Name: 5-ethoxycarbonyl-2,4-diethyl-6-phenyl-pyridine-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-2,4-diethyl-6-phenyl-pyridine-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-2,4-diethyl-6-phenyl-3-pyridinecarboxylic acid IUPAC Name: 5-ethoxycarbonyl-2,4-diethyl-6-phenylpyridine-3-carboxylic acid Traditional Name: 5-carbethoxy-2,4-diethyl-6-phenyl-nicotinic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=C1C(=O)O)CC)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC(=C1C(=O)O)CC)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C19H21NO4/c1-4-13-15(18(21)22)14(5-2)20-17(12-10-8-7-9-11-12)16(13)19(23)24-6-3/h7-11H,4-6H2,1-3H3,(H,21,22)