4-oxidanylidene-3-phenylmethoxy-1-propyl-pyridine-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-phenylmethoxy-1-propyl-pyridine-2-carboxylic acid Openeye Name: 3-benzyloxy-4-oxo-1-propyl-pyridine-2-carboxylic acid CAS Name: 4-oxo-3-phenylmethoxy-1-propyl-2-pyridinecarboxylic acid IUPAC Name: 4-oxo-3-phenylmethoxy-1-propylpyridine-2-carboxylic acid Traditional Name: 3-benzoxy-4-keto-1-propyl-picolinic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC(=O)C(=C1C(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

CCCN1C=CC(=O)C(=C1C(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H17NO4/c1-2-9-17-10-8-13(18)15(14(17)16(19)20)21-11-12-6-4-3-5-7-12/h3-8,10H,2,9,11H2,1H3,(H,19,20)