(3S,11bR)-9,10-dimethoxy-3-methyl-11b-(phenylmethyl)-2,3,6,7-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione

Systemtic Name: (3S,11bR)-9,10-dimethoxy-3-methyl-11b-(phenylmethyl)-2,3,6,7-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione Openeye Name: (3S,11bR)-11b-benzyl-9,10-dimethoxy-3-methyl-2,3,6,7-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione CAS Name: (3S,11bR)-9,10-dimethoxy-3-methyl-11b-(phenylmethyl)-2,3,6,7-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione IUPAC Name: (3S,11bR)-11b-benzyl-9,10-dimethoxy-3-methyl-2,3,6,7-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione Traditional Name: (3S,11bR)-11b-benzyl-9,10-dimethoxy-3-methyl-2,3,6,7-tetrahydropyrazin[2,1-a]isoquinoline-1,4-quinone Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N2CCC3=CC(=C(C=C3C2(C(=O)N1)CC4=CC=CC=C4)OC)OC

Isomeric SMILES

C[C@H]1C(=O)N2CCC3=CC(=C(C=C3[C@@]2(C(=O)N1)CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C22H24N2O4/c1-14-20(25)24-10-9-16-11-18(27-2)19(28-3)12-17(16)22(24,21(26)23-14)13-15-7-5-4-6-8-15/h4-8,11-12,14H,9-10,13H2,1-3H3,(H,23,26)/t14-,22+/m0/s1