O2-[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[(1R)-2-(4-acetamidoanilino)-1-methyl-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-[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester O4-ethyl ester IUPAC Name: 2-O-[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester O4-ethyl ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

InChI

InChI=1S/C21H25N3O6/c1-6-29-20(27)17-11(2)18(22-12(17)3)21(28)30-13(4)19(26)24-16-9-7-15(8-10-16)23-14(5)25/h7-10,13,22H,6H2,1-5H3,(H,23,25)(H,24,26)/t13-/m1/s1