O2-[(2S)-1-(4-ethoxycarbonylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[(2S)-1-(4-ethoxycarbonylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[(1S)-2-(4-ethoxycarbonyl-1-piperidyl)-1-methyl-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-[(2S)-1-(4-ethoxycarbonyl-1-piperidinyl)-1-oxopropan-2-yl] ester O4-methyl ester IUPAC Name: 2-O-[(2S)-1-(4-ethoxycarbonylpiperidin-1-yl)-1-oxopropan-2-yl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[(1S)-2-(4-carbethoxypiperidino)-2-keto-1-methyl-ethyl] ester O4-methyl ester Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)OC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)[C@H](C)OC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C20H28N2O7/c1-6-28-18(24)14-7-9-22(10-8-14)17(23)13(4)29-20(26)16-11(2)15(12(3)21-16)19(25)27-5/h13-14,21H,6-10H2,1-5H3/t13-/m0/s1