[4-(trifluoromethyl)phenyl]methyl (9aS)-6-methyl-4,7-bis(oxidanylidene)-8-(phenylmethyl)-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl (9aS)-6-methyl-4,7-bis(oxidanylidene)-8-(phenylmethyl)-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl]methyl (9aS)-8-benzyl-6-methyl-4,7-dioxo-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylate CAS Name: (9aS)-6-methyl-4,7-dioxo-8-(phenylmethyl)-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl (9aS)-8-benzyl-6-methyl-4,7-dioxo-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylate Traditional Name: (9aS)-8-benzyl-4,7-diketo-6-methyl-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxylic acid [4-(trifluoromethyl)benzyl] ester Formula: C24H24F3N3O4 MolecularWeight: 475.46027

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2N1C(=O)CCN2C(=O)OCC3=CC=C(C=C3)C(F)(F)F)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(C[C@H]2N1C(=O)CCN2C(=O)OCC3=CC=C(C=C3)C(F)(F)F)CC4=CC=CC=C4

InChI

InChI=1S/C24H24F3N3O4/c1-16-22(32)28(13-17-5-3-2-4-6-17)14-20-29(12-11-21(31)30(16)20)23(33)34-15-18-7-9-19(10-8-18)24(25,26)27/h2-10,16,20H,11-15H2,1H3/t16?,20-/m1/s1