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

Systemtic Name: 2-[[(3R,4S)-1-oxidanylidene-3-phenyl-2-propyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[(3R,4S)-1-oxo-3-phenyl-2-propyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[(3R,4S)-1-oxo-3-phenyl-2-propyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(3R,4S)-1-oxo-3-phenyl-2-propyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[(3R,4S)-1-keto-3-phenyl-2-propyl-3,4-dihydroisoquinolin-4-yl]methyl]isoindoline-1,3-quinone Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)CN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CCCN1[C@H]([C@@H](C2=CC=CC=C2C1=O)CN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C27H24N2O3/c1-2-16-28-24(18-10-4-3-5-11-18)23(19-12-6-7-13-20(19)25(28)30)17-29-26(31)21-14-8-9-15-22(21)27(29)32/h3-15,23-24H,2,16-17H2,1H3/t23-,24+/m1/s1