2-[6-[1-(2-carboxyethyl)imidazol-2-yl]hexylcarbamoyl]-6-oxidanyl-benzoic acid

Systemtic Name: 2-[6-[1-(2-carboxyethyl)imidazol-2-yl]hexylcarbamoyl]-6-oxidanyl-benzoic acid Openeye Name: 2-[6-[1-(2-carboxyethyl)imidazol-2-yl]hexylcarbamoyl]-6-hydroxy-benzoic acid CAS Name: 2-[[6-[1-(2-carboxyethyl)-2-imidazolyl]hexylamino]-oxomethyl]-6-hydroxybenzoic acid IUPAC Name: 2-[6-[1-(2-carboxyethyl)imidazol-2-yl]hexylcarbamoyl]-6-hydroxybenzoic acid Traditional Name: 2-[6-[1-(2-carboxyethyl)imidazol-2-yl]hexylcarbamoyl]-6-hydroxy-benzoic acid Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)O)C(=O)O)C(=O)NCCCCCCC2=NC=CN2CCC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)O)C(=O)O)C(=O)NCCCCCCC2=NC=CN2CCC(=O)O

InChI

InChI=1S/C20H25N3O6/c24-15-7-5-6-14(18(15)20(28)29)19(27)22-10-4-2-1-3-8-16-21-11-13-23(16)12-9-17(25)26/h5-7,11,13,24H,1-4,8-10,12H2,(H,22,27)(H,25,26)(H,28,29)