1-(2-methoxyethyl)-7-[(4-methoxyphenyl)methyl]-3-naphthalen-1-yl-purine-2,6-dione

Systemtic Name: 1-(2-methoxyethyl)-7-[(4-methoxyphenyl)methyl]-3-naphthalen-1-yl-purine-2,6-dione Openeye Name: 1-(2-methoxyethyl)-7-[(4-methoxyphenyl)methyl]-3-(1-naphthyl)purine-2,6-dione CAS Name: 1-(2-methoxyethyl)-7-[(4-methoxyphenyl)methyl]-3-(1-naphthalenyl)purine-2,6-dione IUPAC Name: 1-(2-methoxyethyl)-7-[(4-methoxyphenyl)methyl]-3-naphthalen-1-ylpurine-2,6-dione Traditional Name: 1-(2-methoxyethyl)-3-(1-naphthyl)-7-p-anisyl-xanthine Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(N=CN2CC3=CC=C(C=C3)OC)N(C1=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

COCCN1C(=O)C2=C(N=CN2CC3=CC=C(C=C3)OC)N(C1=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H24N4O4/c1-33-15-14-29-25(31)23-24(27-17-28(23)16-18-10-12-20(34-2)13-11-18)30(26(29)32)22-9-5-7-19-6-3-4-8-21(19)22/h3-13,17H,14-16H2,1-2H3