2-[[(3R,4S)-2-ethyl-1-oxidanylidene-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[(3R,4S)-2-ethyl-1-oxidanylidene-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[(3R,4S)-2-ethyl-1-oxo-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[(3R,4S)-2-ethyl-1-oxo-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(3R,4S)-2-ethyl-1-oxo-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[(3R,4S)-2-ethyl-1-keto-3-phenyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindoline-1,3-quinone Formula: C26H22N2O3 MolecularWeight: 410.46448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C2=CC=CC=C2C1=O)CN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CCN1[C@H]([C@@H](C2=CC=CC=C2C1=O)CN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O3/c1-2-27-23(17-10-4-3-5-11-17)22(18-12-6-7-13-19(18)24(27)29)16-28-25(30)20-14-8-9-15-21(20)26(28)31/h3-15,22-23H,2,16H2,1H3/t22-,23+/m1/s1