4-[[(1R)-1-(1-benzofuran-2-yl)ethyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[[(1R)-1-(1-benzofuran-2-yl)ethyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[[(1R)-1-(benzofuran-2-yl)ethyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[(1R)-1-(2-benzofuranyl)ethyl]iminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[[(1R)-1-(1-benzofuran-2-yl)ethyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[[(1R)-1-(benzofuran-2-yl)ethyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)N=CC3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=N5

Isomeric SMILES

C[C@H](C1=CC2=CC=CC=C2O1)N=CC3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=N5

InChI

InChI=1S/C25H19N3O3/c1-16(22-14-17-8-2-5-11-21(17)31-22)27-15-20-18-9-3-4-10-19(18)24(29)28(25(20)30)23-12-6-7-13-26-23/h2-16,20H,1H3/t16-,20?/m1/s1