2-[(3,4,5-trimethoxyphenyl)carbonylamino]hexanedioic acid

Systemtic Name: 2-[(3,4,5-trimethoxyphenyl)carbonylamino]hexanedioic acid Openeye Name: 2-[(3,4,5-trimethoxybenzoyl)amino]hexanedioic acid CAS Name: 2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]hexanedioic acid IUPAC Name: 2-[(3,4,5-trimethoxybenzoyl)amino]hexanedioic acid Traditional Name: 2-[(3,4,5-trimethoxybenzoyl)amino]adipic acid Formula: C16H21NO8 MolecularWeight: 355.33984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCCC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCCC(=O)O)C(=O)O

InChI

InChI=1S/C16H21NO8/c1-23-11-7-9(8-12(24-2)14(11)25-3)15(20)17-10(16(21)22)5-4-6-13(18)19/h7-8,10H,4-6H2,1-3H3,(H,17,20)(H,18,19)(H,21,22)