O1-tert-butyl O4-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] ester O1-tert-butyl ester IUPAC Name: 4-O-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] 1-O-tert-butyl piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl] ester O1-tert-butyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O6/c1-12-17(14(3)24)13(2)22-18(12)16(25)11-28-19(26)15-7-9-23(10-8-15)20(27)29-21(4,5)6/h15,22H,7-11H2,1-6H3