O2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester O4-ethyl ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C19H20N2O7/c1-4-25-18(23)16-10(2)17(20-11(16)3)19(24)26-8-15(22)21-12-5-6-13-14(7-12)28-9-27-13/h5-7,20H,4,8-9H2,1-3H3,(H,21,22)