(4R)-4-(1-adamantyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: (4R)-4-(1-adamantyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: (4R)-4-(1-adamantyliminomethyl)-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: (4R)-4-(1-adamantyliminomethyl)-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4R)-4-(1-adamantyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: (4R)-4-(1-adamantyliminomethyl)-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N=CC4C5=CC=CC=C5C(=O)N(C4=O)C6=CC=CC=N6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N=C[C@H]4C5=CC=CC=C5C(=O)N(C4=O)C6=CC=CC=N6

InChI

InChI=1S/C25H25N3O2/c29-23-20-6-2-1-5-19(20)21(24(30)28(23)22-7-3-4-8-26-22)15-27-25-12-16-9-17(13-25)11-18(10-16)14-25/h1-8,15-18,21H,9-14H2/t16?,17?,18?,21-,25?/m0/s1