2-[[3-(1,3-benzodioxol-5-ylcarbamoyloxymethyl)-4-ethoxy-phenyl]methyl]oxolane-2-carboxylic acid

Systemtic Name: 2-[[3-(1,3-benzodioxol-5-ylcarbamoyloxymethyl)-4-ethoxy-phenyl]methyl]oxolane-2-carboxylic acid Openeye Name: 2-[[3-(1,3-benzodioxol-5-ylcarbamoyloxymethyl)-4-ethoxy-phenyl]methyl]tetrahydrofuran-2-carboxylic acid CAS Name: 2-[[3-[[(1,3-benzodioxol-5-ylamino)-oxomethoxy]methyl]-4-ethoxyphenyl]methyl]-2-oxolanecarboxylic acid IUPAC Name: 2-[[3-(1,3-benzodioxol-5-ylcarbamoyloxymethyl)-4-ethoxyphenyl]methyl]oxolane-2-carboxylic acid Traditional Name: 2-[3-(1,3-benzodioxol-5-ylcarbamoyloxymethyl)-4-ethoxy-benzyl]tetrahydrofuran-2-carboxylic acid Formula: C23H25NO8 MolecularWeight: 443.4465

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2(CCCO2)C(=O)O)COC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2(CCCO2)C(=O)O)COC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25NO8/c1-2-28-18-6-4-15(12-23(21(25)26)8-3-9-32-23)10-16(18)13-29-22(27)24-17-5-7-19-20(11-17)31-14-30-19/h4-7,10-11H,2-3,8-9,12-14H2,1H3,(H,24,27)(H,25,26)