5-ethoxycarbonyl-2-[[(3-methoxyphenyl)methyl-methyl-azaniumyl]methyl]-6-methyl-furo[2,3-d]pyrimidin-4-olate

Systemtic Name: 5-ethoxycarbonyl-2-[[(3-methoxyphenyl)methyl-methyl-azaniumyl]methyl]-6-methyl-furo[2,3-d]pyrimidin-4-olate Openeye Name: 5-ethoxycarbonyl-2-[[(3-methoxyphenyl)methyl-methyl-ammonio]methyl]-6-methyl-furo[2,3-d]pyrimidin-4-olate CAS Name: 5-ethoxycarbonyl-2-[[(3-methoxyphenyl)methyl-methylammonio]methyl]-6-methyl-4-furo[2,3-d]pyrimidinolate IUPAC Name: 5-ethoxycarbonyl-2-[[(3-methoxyphenyl)methyl-methylazaniumyl]methyl]-6-methylfuro[2,3-d]pyrimidin-4-olate Traditional Name: 5-carbethoxy-2-[[m-anisyl(methyl)ammonio]methyl]-6-methyl-furo[2,3-d]pyrimidin-4-olate Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)[O-])C[NH+](C)CC3=CC(=CC=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)[O-])C[NH+](C)CC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C20H23N3O5/c1-5-27-20(25)16-12(2)28-19-17(16)18(24)21-15(22-19)11-23(3)10-13-7-6-8-14(9-13)26-4/h6-9H,5,10-11H2,1-4H3,(H,21,22,24)