4-[[4-(dimethylaminomethyl)phenyl]methyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[[4-(dimethylaminomethyl)phenyl]methyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[[4-(dimethylaminomethyl)phenyl]methyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[4-(dimethylaminomethyl)phenyl]methyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[[4-(dimethylaminomethyl)phenyl]methyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[[4-(dimethylaminomethyl)benzyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C25H24N4O2 MolecularWeight: 412.48366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C25H24N4O2/c1-28(2)17-19-12-10-18(11-13-19)15-26-16-22-20-7-3-4-8-21(20)24(30)29(25(22)31)23-9-5-6-14-27-23/h3-14,16,22H,15,17H2,1-2H3