[3-methyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl-dipropyl-azanium

Systemtic Name: [3-methyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl-dipropyl-azanium Openeye Name: (3-methyl-2,6-dioxo-7-propyl-purin-8-yl)methyl-dipropyl-ammonium CAS Name: (3-methyl-2,6-dioxo-7-propyl-8-purinyl)methyl-dipropylammonium IUPAC Name: (3-methyl-2,6-dioxo-7-propylpurin-8-yl)methyl-dipropylazanium Traditional Name: (2,6-diketo-3-methyl-7-propyl-purin-8-yl)methyl-dipropyl-ammonium Formula: C16H28N5O2+ MolecularWeight: 322.42582

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NC2=C1C(=O)NC(=O)N2C)C[NH+](CCC)CCC

Isomeric SMILES

CCCN1C(=NC2=C1C(=O)NC(=O)N2C)C[NH+](CCC)CCC

InChI

InChI=1S/C16H27N5O2/c1-5-8-20(9-6-2)11-12-17-14-13(21(12)10-7-3)15(22)18-16(23)19(14)4/h5-11H2,1-4H3,(H,18,22,23)/p+1