2-azanyl-9-butyl-7-prop-2-enyl-3H-purine-6,8-dione

Systemtic Name: 2-azanyl-9-butyl-7-prop-2-enyl-3H-purine-6,8-dione Openeye Name: 7-allyl-2-amino-9-butyl-3H-purine-6,8-dione CAS Name: 2-amino-9-butyl-7-prop-2-enyl-3H-purine-6,8-dione IUPAC Name: 2-amino-9-butyl-7-prop-2-enyl-3H-purine-6,8-dione Traditional Name: 7-allyl-2-amino-9-butyl-3H-purine-6,8-quinone Formula: C12H17N5O2 MolecularWeight: 263.29568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N=C(N2)N)N(C1=O)CC=C

Isomeric SMILES

CCCCN1C2=C(C(=O)N=C(N2)N)N(C1=O)CC=C

InChI

InChI=1S/C12H17N5O2/c1-3-5-7-17-9-8(10(18)15-11(13)14-9)16(6-4-2)12(17)19/h4H,2-3,5-7H2,1H3,(H3,13,14,15,18)