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

Systemtic Name: 6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Openeye Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one CAS Name: 6-(phenylmethyl)-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one IUPAC Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Traditional Name: 6-benzyl-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-4-one Formula: C14H16N3O+ MolecularWeight: 242.29634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O/c18-14-12-9-17(7-6-13(12)15-10-16-14)8-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,15,16,18)/p+1