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

Systemtic Name: O1-tert-butyl O2-methyl 4-(3,4,5-trimethoxyphenyl)carbonylpiperazine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl 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-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl 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-methyl ester Formula: C21H30N2O8 MolecularWeight: 438.4715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1C(=O)OC)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1C(=O)OC)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H30N2O8/c1-21(2,3)31-20(26)23-9-8-22(12-14(23)19(25)30-7)18(24)13-10-15(27-4)17(29-6)16(11-13)28-5/h10-11,14H,8-9,12H2,1-7H3