3-(8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)propanoic acid

Systemtic Name: 3-(8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)propanoic acid Openeye Name: 3-(8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)propanoic acid CAS Name: 3-(8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)propanoic acid IUPAC Name: 3-(8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)propanoic acid Traditional Name: 3-(8-keto-5,6-dihydroisoquinolin[2,1-b]isoquinolin-13-yl)propionic acid Formula: C20H17NO3 MolecularWeight: 319.35388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=C(C3=CC=CC=C3C2=O)CCC(=O)O)C4=CC=CC=C41

Isomeric SMILES

C1CN2C(=C(C3=CC=CC=C3C2=O)CCC(=O)O)C4=CC=CC=C41

InChI

InChI=1S/C20H17NO3/c22-18(23)10-9-16-15-7-3-4-8-17(15)20(24)21-12-11-13-5-1-2-6-14(13)19(16)21/h1-8H,9-12H2,(H,22,23)