[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C25H18N2O3 MolecularWeight: 394.42202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H18N2O3/c1-2-14-26-24(28)16-30-25(29)21-15-23(27-22-13-6-5-11-20(21)22)19-12-7-9-17-8-3-4-10-18(17)19/h1,3-13,15H,14,16H2,(H,26,28)