2-pyridin-3-ylcarbonyl-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one

Systemtic Name: 2-pyridin-3-ylcarbonyl-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one Openeye Name: 2-(pyridine-3-carbonyl)-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one CAS Name: 2-[oxo(3-pyridinyl)methyl]-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one IUPAC Name: 2-(pyridine-3-carbonyl)-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one Traditional Name: 2-nicotinoyl-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C3CN(CC(=O)N3C1)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CC2=CC=CC=C2C3CN(CC(=O)N3C1)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H19N3O2/c23-18-13-21(19(24)15-6-3-9-20-11-15)12-17-16-8-2-1-5-14(16)7-4-10-22(17)18/h1-3,5-6,8-9,11,17H,4,7,10,12-13H2