2-[(3,4,5-trimethoxyphenyl)methylamino]pentanedioic acid

Systemtic Name: 2-[(3,4,5-trimethoxyphenyl)methylamino]pentanedioic acid Openeye Name: 2-[(3,4,5-trimethoxyphenyl)methylamino]pentanedioic acid CAS Name: 2-[(3,4,5-trimethoxyphenyl)methylamino]pentanedioic acid IUPAC Name: 2-[(3,4,5-trimethoxyphenyl)methylamino]pentanedioic acid Traditional Name: 2-[(3,4,5-trimethoxybenzyl)amino]glutaric acid Formula: C15H21NO7 MolecularWeight: 327.32974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(CCC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C15H21NO7/c1-21-11-6-9(7-12(22-2)14(11)23-3)8-16-10(15(19)20)4-5-13(17)18/h6-7,10,16H,4-5,8H2,1-3H3,(H,17,18)(H,19,20)