2-methoxy-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonyloxy-benzoic acid

Systemtic Name: 2-methoxy-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbonyloxy-benzoic acid Openeye Name: 4-[4-(tert-butoxycarbonylamino)cyclohexanecarbonyl]oxy-2-methoxy-benzoic acid CAS Name: 2-methoxy-4-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclohexyl]-oxomethoxy]benzoic acid IUPAC Name: 2-methoxy-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexanecarbonyl]oxybenzoic acid Traditional Name: 4-[4-(tert-butoxycarbonylamino)cyclohexanecarbonyl]oxy-2-methoxy-benzoic acid Formula: C20H27NO7 MolecularWeight: 393.43088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C20H27NO7/c1-20(2,3)28-19(25)21-13-7-5-12(6-8-13)18(24)27-14-9-10-15(17(22)23)16(11-14)26-4/h9-13H,5-8H2,1-4H3,(H,21,25)(H,22,23)