2-[2-[[3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[2-[[3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[2-[[1-[[4-[6-(tert-butoxycarbonylamino)hexoxy]phenyl]methyl]-2-hydroxy-2-oxo-ethyl]amino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[[1-hydroxy-3-[4-[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexoxy]phenyl]-1-oxopropan-2-yl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 2-[2-[[1-hydroxy-3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]-1-oxopropan-2-yl]amino]-2-oxoethyl]benzoic acid Traditional Name: 2-[2-[[1-[4-[6-(tert-butoxycarbonylamino)hexoxy]benzyl]-2-hydroxy-2-keto-ethyl]amino]-2-keto-ethyl]benzoic acid Formula: C29H38N2O8 MolecularWeight: 542.62062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCCOC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCCOC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C29H38N2O8/c1-29(2,3)39-28(37)30-16-8-4-5-9-17-38-22-14-12-20(13-15-22)18-24(27(35)36)31-25(32)19-21-10-6-7-11-23(21)26(33)34/h6-7,10-15,24H,4-5,8-9,16-19H2,1-3H3,(H,30,37)(H,31,32)(H,33,34)(H,35,36)