7-[ethoxy(phenyl)methyl]-1-methyl-3-(2-methylpropyl)purine-2,6-dione

Systemtic Name: 7-[ethoxy(phenyl)methyl]-1-methyl-3-(2-methylpropyl)purine-2,6-dione Openeye Name: 7-[ethoxy(phenyl)methyl]-3-isobutyl-1-methyl-purine-2,6-dione CAS Name: 7-[ethoxy(phenyl)methyl]-1-methyl-3-(2-methylpropyl)purine-2,6-dione IUPAC Name: 7-[ethoxy(phenyl)methyl]-1-methyl-3-(2-methylpropyl)purine-2,6-dione Traditional Name: 7-[ethoxy(phenyl)methyl]-3-isobutyl-1-methyl-xanthine Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3CC(C)C)C

Isomeric SMILES

CCOC(C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3CC(C)C)C

InChI

InChI=1S/C19H24N4O3/c1-5-26-18(14-9-7-6-8-10-14)23-12-20-16-15(23)17(24)21(4)19(25)22(16)11-13(2)3/h6-10,12-13,18H,5,11H2,1-4H3