3-[6-[(3-carboxyphenyl)carbonylamino]hexylcarbamoyl]benzoic acid

Systemtic Name: 3-[6-[(3-carboxyphenyl)carbonylamino]hexylcarbamoyl]benzoic acid Openeye Name: 3-[6-[(3-carboxybenzoyl)amino]hexylcarbamoyl]benzoic acid CAS Name: 3-[[6-[[(3-carboxyphenyl)-oxomethyl]amino]hexylamino]-oxomethyl]benzoic acid IUPAC Name: 3-[6-[(3-carboxybenzoyl)amino]hexylcarbamoyl]benzoic acid Traditional Name: 3-[6-[(3-carboxybenzoyl)amino]hexylcarbamoyl]benzoic acid Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C(=O)NCCCCCCNC(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C(=O)NCCCCCCNC(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C22H24N2O6/c25-19(15-7-5-9-17(13-15)21(27)28)23-11-3-1-2-4-12-24-20(26)16-8-6-10-18(14-16)22(29)30/h5-10,13-14H,1-4,11-12H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)