1-(2-methoxyethyl)-3-naphthalen-1-yl-7-propan-2-yl-purine-2,6-dione

Systemtic Name: 1-(2-methoxyethyl)-3-naphthalen-1-yl-7-propan-2-yl-purine-2,6-dione Openeye Name: 7-isopropyl-1-(2-methoxyethyl)-3-(1-naphthyl)purine-2,6-dione CAS Name: 1-(2-methoxyethyl)-3-(1-naphthalenyl)-7-propan-2-ylpurine-2,6-dione IUPAC Name: 1-(2-methoxyethyl)-3-naphthalen-1-yl-7-propan-2-ylpurine-2,6-dione Traditional Name: 7-isopropyl-1-(2-methoxyethyl)-3-(1-naphthyl)xanthine Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC4=CC=CC=C43)CCOC

Isomeric SMILES

CC(C)N1C=NC2=C1C(=O)N(C(=O)N2C3=CC=CC4=CC=CC=C43)CCOC

InChI

InChI=1S/C21H22N4O3/c1-14(2)24-13-22-19-18(24)20(26)23(11-12-28-3)21(27)25(19)17-10-6-8-15-7-4-5-9-16(15)17/h4-10,13-14H,11-12H2,1-3H3