O1-tert-butyl O2-ethyl 4-(3,4,5-trimethoxyphenyl)carbonylpiperazine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl 4-(3,4,5-trimethoxyphenyl)carbonylpiperazine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1,2-dicarboxylate CAS Name: 4-[oxo-(3,4,5-trimethoxyphenyl)methyl]piperazine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1,2-dicarboxylate Traditional Name: 4-(3,4,5-trimethoxybenzoyl)piperazine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C22H32N2O8 MolecularWeight: 452.49808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCN1C(=O)OC(C)(C)C)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1CN(CCN1C(=O)OC(C)(C)C)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H32N2O8/c1-8-31-20(26)15-13-23(9-10-24(15)21(27)32-22(2,3)4)19(25)14-11-16(28-5)18(30-7)17(12-14)29-6/h11-12,15H,8-10,13H2,1-7H3