7-(phenylmethyl)-2-piperidin-1-yl-3,9-dihydropurin-7-ium-6-one

Systemtic Name: 7-(phenylmethyl)-2-piperidin-1-yl-3,9-dihydropurin-7-ium-6-one Openeye Name: 7-benzyl-2-(1-piperidyl)-3,9-dihydropurin-7-ium-6-one CAS Name: 7-(phenylmethyl)-2-(1-piperidinyl)-3,9-dihydropurin-7-ium-6-one IUPAC Name: 7-benzyl-2-piperidin-1-yl-3,9-dihydropurin-7-ium-6-one Traditional Name: 7-benzyl-2-piperidino-3,9-dihydropurin-7-ium-6-one Formula: C17H20N5O+ MolecularWeight: 310.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=O)C3=C(N2)NC=[N+]3CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=O)C3=C(N2)NC=[N+]3CC4=CC=CC=C4

InChI

InChI=1S/C17H19N5O/c23-16-14-15(19-17(20-16)21-9-5-2-6-10-21)18-12-22(14)11-13-7-3-1-4-8-13/h1,3-4,7-8,12H,2,5-6,9-11H2,(H,19,20,23)/p+1