3-methyl-8-morpholin-4-ium-4-ylidene-7-propyl-9H-purine-2,6-dione

Systemtic Name: 3-methyl-8-morpholin-4-ium-4-ylidene-7-propyl-9H-purine-2,6-dione Openeye Name: 3-methyl-8-morpholin-4-ium-4-ylidene-7-propyl-9H-purine-2,6-dione CAS Name: 3-methyl-8-(4-morpholin-4-iumylidene)-7-propyl-9H-purine-2,6-dione IUPAC Name: 3-methyl-8-morpholin-4-ium-4-ylidene-7-propyl-9H-purine-2,6-dione Traditional Name: 3-methyl-8-morpholin-4-ium-4-ylidene-7-propyl-9H-purine-2,6-quinone Formula: C13H20N5O3+ MolecularWeight: 294.3296

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(NC1=[N+]3CCOCC3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCN1C2=C(NC1=[N+]3CCOCC3)N(C(=O)NC2=O)C

InChI

InChI=1S/C13H19N5O3/c1-3-4-18-9-10(16(2)13(20)15-11(9)19)14-12(18)17-5-7-21-8-6-17/h3-8H2,1-2H3,(H,15,19,20)/p+1