6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-dione

Systemtic Name: 6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-dione Openeye Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-dione CAS Name: 6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-dione IUPAC Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-dione Traditional Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2,4-quinone Formula: C14H16N3O2+ MolecularWeight: 258.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1NC(=O)NC2=O)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC2=C1NC(=O)NC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C14H15N3O2/c18-13-11-9-17(8-10-4-2-1-3-5-10)7-6-12(11)15-14(19)16-13/h1-5H,6-9H2,(H2,15,16,18,19)/p+1