5-(5-oxidanylidene-5-phenylmethoxy-pentyl)pyridine-2-carboxylic acid

Systemtic Name: 5-(5-oxidanylidene-5-phenylmethoxy-pentyl)pyridine-2-carboxylic acid Openeye Name: 5-(5-benzyloxy-5-oxo-pentyl)pyridine-2-carboxylic acid CAS Name: 5-(5-oxo-5-phenylmethoxypentyl)-2-pyridinecarboxylic acid IUPAC Name: 5-(5-oxo-5-phenylmethoxypentyl)pyridine-2-carboxylic acid Traditional Name: 5-(5-benzoxy-5-keto-pentyl)picolinic acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCC2=CN=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCC2=CN=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO4/c20-17(23-13-15-7-2-1-3-8-15)9-5-4-6-14-10-11-16(18(21)22)19-12-14/h1-3,7-8,10-12H,4-6,9,13H2,(H,21,22)