6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-dione

Systemtic Name: 6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-dione Openeye Name: 6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-dione CAS Name: 6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-dione IUPAC Name: 6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-dione Traditional Name: 6-phenethyl-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-6-ium-2,4-quinone Formula: C20H21N4O2+ MolecularWeight: 349.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(NC[NH+]1CCC3=CC=CC=C3)N(C(=O)NC2=O)C4=CC=CC=C4

Isomeric SMILES

C1C2=C(NC[NH+]1CCC3=CC=CC=C3)N(C(=O)NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O2/c25-19-17-13-23(12-11-15-7-3-1-4-8-15)14-21-18(17)24(20(26)22-19)16-9-5-2-6-10-16/h1-10,21H,11-14H2,(H,22,25,26)/p+1