4-(phenethyliminomethyl)-2-(phenylmethyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 4-(phenethyliminomethyl)-2-(phenylmethyl)-4H-isoquinoline-1,3-dione Openeye Name: 2-benzyl-4-(phenethyliminomethyl)-4H-isoquinoline-1,3-dione CAS Name: 4-(phenethyliminomethyl)-2-(phenylmethyl)-4H-isoquinoline-1,3-dione IUPAC Name: 2-benzyl-4-(phenethyliminomethyl)-4H-isoquinoline-1,3-dione Traditional Name: 2-benzyl-4-(phenethyliminomethyl)-4H-isoquinoline-1,3-quinone Formula: C25H22N2O2 MolecularWeight: 382.45438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN=CC2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN=CC2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2/c28-24-22-14-8-7-13-21(22)23(17-26-16-15-19-9-3-1-4-10-19)25(29)27(24)18-20-11-5-2-6-12-20/h1-14,17,23H,15-16,18H2