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

Systemtic Name: 8-(phenylcarbonyloxy)-5-(3-piperidin-1-ylprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid Openeye Name: 8-benzoyloxy-5-[3-(1-piperidyl)prop-1-ynyl]-1,6-naphthyridine-7-carboxylic acid CAS Name: 8-benzoyloxy-5-[3-(1-piperidinyl)prop-1-ynyl]-1,6-naphthyridine-7-carboxylic acid IUPAC Name: 8-benzoyloxy-5-(3-piperidin-1-ylprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid Traditional Name: 8-benzoyloxy-5-(3-piperidinoprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CC2=C3C=CC=NC3=C(C(=N2)C(=O)O)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC#CC2=C3C=CC=NC3=C(C(=N2)C(=O)O)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O4/c28-23(29)21-22(31-24(30)17-9-3-1-4-10-17)20-18(11-7-13-25-20)19(26-21)12-8-16-27-14-5-2-6-15-27/h1,3-4,7,9-11,13H,2,5-6,14-16H2,(H,28,29)