1,3-dimethyl-6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]carbonyl-pyrido[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]carbonyl-pyrido[2,3-d]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-6-[[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-oxomethyl]pyrido[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-6-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-quinone Formula: C21H24N5O3+ MolecularWeight: 394.44696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C(=O)N(C(=O)N4C)C

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C21H23N5O3/c1-23-9-10-26(17(13-23)14-7-5-4-6-8-14)19(27)15-11-16-18(22-12-15)24(2)21(29)25(3)20(16)28/h4-8,11-12,17H,9-10,13H2,1-3H3/p+1/t17-/m0/s1