O2-(1,3-benzodioxol-5-yl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-(1,3-benzodioxol-5-yl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-(1,3-benzodioxol-5-yl) O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1,3-benzodioxol-5-yl) ester O4-ethyl ester IUPAC Name: 2-O-(1,3-benzodioxol-5-yl) 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(1,3-benzodioxol-5-yl) ester O4-ethyl ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H17NO6/c1-4-21-16(19)14-9(2)15(18-10(14)3)17(20)24-11-5-6-12-13(7-11)23-8-22-12/h5-7,18H,4,8H2,1-3H3