5-(2,3,4-trimethoxyphenyl)carbonylpiperazine-2-carboxylic acid

Systemtic Name: 5-(2,3,4-trimethoxyphenyl)carbonylpiperazine-2-carboxylic acid Openeye Name: 5-(2,3,4-trimethoxybenzoyl)piperazine-2-carboxylic acid CAS Name: 5-[oxo-(2,3,4-trimethoxyphenyl)methyl]-2-piperazinecarboxylic acid IUPAC Name: 5-(2,3,4-trimethoxybenzoyl)piperazine-2-carboxylic acid Traditional Name: 5-(2,3,4-trimethoxybenzoyl)piperazine-2-carboxylic acid Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)C2CNC(CN2)C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)C2CNC(CN2)C(=O)O)OC)OC

InChI

InChI=1S/C15H20N2O6/c1-21-11-5-4-8(13(22-2)14(11)23-3)12(18)9-6-17-10(7-16-9)15(19)20/h4-5,9-10,16-17H,6-7H2,1-3H3,(H,19,20)