(5-ethoxycarbonyl-6-methyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)methyl-[(4-ethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (5-ethoxycarbonyl-6-methyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)methyl-[(4-ethoxyphenyl)methyl]-methyl-azanium Openeye Name: (5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl-[(4-ethoxyphenyl)methyl]-methyl-ammonium CAS Name: (5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl-[(4-ethoxyphenyl)methyl]-methylammonium IUPAC Name: (5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl-[(4-ethoxyphenyl)methyl]-methylazanium Traditional Name: (5-carbethoxy-4-keto-6-methyl-3H-furo[2,3-d]pyrimidin-2-yl)methyl-(4-ethoxybenzyl)-methyl-ammonium Formula: C21H26N3O5+ MolecularWeight: 400.44824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+](C)CC2=NC3=C(C(=C(O3)C)C(=O)OCC)C(=O)N2

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+](C)CC2=NC3=C(C(=C(O3)C)C(=O)OCC)C(=O)N2

InChI

InChI=1S/C21H25N3O5/c1-5-27-15-9-7-14(8-10-15)11-24(4)12-16-22-19(25)18-17(21(26)28-6-2)13(3)29-20(18)23-16/h7-10H,5-6,11-12H2,1-4H3,(H,22,23,25)/p+1