1,3-benzodioxol-5-ylmethyl-[(5-ethoxycarbonyl-6-methyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)methyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(5-ethoxycarbonyl-6-methyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)methyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(5-ethoxycarbonyl-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)methyl]-methylazanium Traditional Name: (5-carbethoxy-4-keto-6-methyl-3H-furo[2,3-d]pyrimidin-2-yl)methyl-methyl-piperonyl-ammonium Formula: C20H22N3O6+ MolecularWeight: 400.40518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=O)NC(=N2)C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=O)NC(=N2)C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H21N3O6/c1-4-26-20(25)16-11(2)29-19-17(16)18(24)21-15(22-19)9-23(3)8-12-5-6-13-14(7-12)28-10-27-13/h5-7H,4,8-10H2,1-3H3,(H,21,22,24)/p+1