2-azanyl-9-(phenylmethyl)-7-prop-2-enyl-3H-purine-6,8-dione

Systemtic Name: 2-azanyl-9-(phenylmethyl)-7-prop-2-enyl-3H-purine-6,8-dione Openeye Name: 7-allyl-2-amino-9-benzyl-3H-purine-6,8-dione CAS Name: 2-amino-9-(phenylmethyl)-7-prop-2-enyl-3H-purine-6,8-dione IUPAC Name: 2-amino-9-benzyl-7-prop-2-enyl-3H-purine-6,8-dione Traditional Name: 7-allyl-2-amino-9-benzyl-3H-purine-6,8-quinone Formula: C15H15N5O2 MolecularWeight: 297.3119

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(NC(=NC2=O)N)N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

C=CCN1C2=C(NC(=NC2=O)N)N(C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C15H15N5O2/c1-2-8-19-11-12(17-14(16)18-13(11)21)20(15(19)22)9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H3,16,17,18,21)