8-(4-methoxyphenyl)-1-methyl-6-oxidanylidene-9-propyl-purin-2-olate; triethylazanium

Systemtic Name: 8-(4-methoxyphenyl)-1-methyl-6-oxidanylidene-9-propyl-purin-2-olate; triethylazanium Openeye Name: 8-(4-methoxyphenyl)-1-methyl-6-oxo-9-propyl-purin-2-olate; triethylammonium CAS Name: 8-(4-methoxyphenyl)-1-methyl-6-oxo-9-propyl-2-purinolate; triethylammonium IUPAC Name: 8-(4-methoxyphenyl)-1-methyl-6-oxo-9-propylpurin-2-olate; triethylazanium Traditional Name: 6-keto-8-(4-methoxyphenyl)-1-methyl-9-propyl-purin-2-olate; triethylammonium Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C(=N2)[O-])C)N=C1C3=CC=C(C=C3)OC.CC[NH+](CC)CC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C(=N2)[O-])C)N=C1C3=CC=C(C=C3)OC.CC[NH+](CC)CC

InChI

InChI=1S/C16H18N4O3.C6H15N/c1-4-9-20-13(10-5-7-11(23-3)8-6-10)17-12-14(20)18-16(22)19(2)15(12)21;1-4-7(5-2)6-3/h5-8H,4,9H2,1-3H3,(H,18,22);4-6H2,1-3H3