O2-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(3-iodoanilino)-2-oxo-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(3-iodoanilino)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(3-iodoanilino)-2-oxoethyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(3-iodoanilino)-2-keto-ethyl] ester O4-methyl ester Formula: C17H17IN2O5 MolecularWeight: 456.23175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C17H17IN2O5/c1-9-14(16(22)24-3)10(2)19-15(9)17(23)25-8-13(21)20-12-6-4-5-11(18)7-12/h4-7,19H,8H2,1-3H3,(H,20,21)