2-(3-hydroxyphenyl)-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]benzoic acid

Systemtic Name: 2-(3-hydroxyphenyl)-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]benzoic acid Openeye Name: 4-[2-(tert-butoxycarbonylamino)hexanoylamino]-2-(3-hydroxyphenyl)benzoic acid CAS Name: 2-(3-hydroxyphenyl)-4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]benzoic acid IUPAC Name: 2-(3-hydroxyphenyl)-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]benzoic acid Traditional Name: 4-[2-(tert-butoxycarbonylamino)hexanoylamino]-2-(3-hydroxyphenyl)benzoic acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC(=CC=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC(=CC=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H30N2O6/c1-5-6-10-20(26-23(31)32-24(2,3)4)21(28)25-16-11-12-18(22(29)30)19(14-16)15-8-7-9-17(27)13-15/h7-9,11-14,20,27H,5-6,10H2,1-4H3,(H,25,28)(H,26,31)(H,29,30)