ethyl 6-methyl-3-[(4-methylphenyl)methyl]-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-3-[(4-methylphenyl)methyl]-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-4-oxo-3-(p-tolylmethyl)furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 6-methyl-3-[(4-methylphenyl)methyl]-4-oxo-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-3-[(4-methylphenyl)methyl]-4-oxofuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-6-methyl-3-(4-methylbenzyl)furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C18H18N2O4/c1-4-23-18(22)14-12(3)24-16-15(14)17(21)20(10-19-16)9-13-7-5-11(2)6-8-13/h5-8,10H,4,9H2,1-3H3