(3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one

Systemtic Name: (3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one Openeye Name: (3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one CAS Name: (3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one IUPAC Name: (3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-4-one Traditional Name: (3S,11aS)-1-methoxy-3-methyl-3,6,11,11a-tetrahydropyrazin[1,2-b]isoquinolin-4-one Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N2CC3=CC=CC=C3CC2C(=N1)OC

Isomeric SMILES

C[C@H]1C(=O)N2CC3=CC=CC=C3C[C@H]2C(=N1)OC

InChI

InChI=1S/C14H16N2O2/c1-9-14(17)16-8-11-6-4-3-5-10(11)7-12(16)13(15-9)18-2/h3-6,9,12H,7-8H2,1-2H3/t9-,12-/m0/s1