5-(3-oxidanylprop-1-ynyl)-8-(phenylcarbonyloxy)-1,6-naphthyridine-7-carboxylic acid

Systemtic Name: 5-(3-oxidanylprop-1-ynyl)-8-(phenylcarbonyloxy)-1,6-naphthyridine-7-carboxylic acid Openeye Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid CAS Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid IUPAC Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid Traditional Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid Formula: C19H12N2O5 MolecularWeight: 348.30898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C3C(=C(N=C2C(=O)O)C#CCO)C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C3C(=C(N=C2C(=O)O)C#CCO)C=CC=N3

InChI

InChI=1S/C19H12N2O5/c22-11-5-9-14-13-8-4-10-20-15(13)17(16(21-14)18(23)24)26-19(25)12-6-2-1-3-7-12/h1-4,6-8,10,22H,11H2,(H,23,24)