7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)-6-oxidanylidene-purin-2-olate

Systemtic Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)-6-oxidanylidene-purin-2-olate Openeye Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)-6-oxo-purin-2-olate CAS Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)-6-oxo-2-purinolate IUPAC Name: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)-6-oxopurin-2-olate Traditional Name: 6-keto-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(methylamino)purin-2-olate Formula: C16H18N5O3- MolecularWeight: 328.34582

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)N=C(N2C)[O-]

Isomeric SMILES

CNC1=NC2=C(N1CCC3=CC=C(C=C3)OC)C(=O)N=C(N2C)[O-]

InChI

InChI=1S/C16H19N5O3/c1-17-15-18-13-12(14(22)19-16(23)20(13)2)21(15)9-8-10-4-6-11(24-3)7-5-10/h4-7H,8-9H2,1-3H3,(H,17,18)(H,19,22,23)/p-1