6-azanyl-9-[(3,4-dimethoxyphenyl)methyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-9-[(3,4-dimethoxyphenyl)methyl]-7H-purin-8-one Openeye Name: 6-amino-9-[(3,4-dimethoxyphenyl)methyl]-7H-purin-8-one CAS Name: 6-amino-9-[(3,4-dimethoxyphenyl)methyl]-7H-purin-8-one IUPAC Name: 6-amino-9-[(3,4-dimethoxyphenyl)methyl]-7H-purin-8-one Traditional Name: 6-amino-9-veratryl-7H-purin-8-one Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C(=NC=N3)N)NC2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C(=NC=N3)N)NC2=O)OC

InChI

InChI=1S/C14H15N5O3/c1-21-9-4-3-8(5-10(9)22-2)6-19-13-11(18-14(19)20)12(15)16-7-17-13/h3-5,7H,6H2,1-2H3,(H,18,20)(H2,15,16,17)