methyl 3-[12-[(2-methylpropan-2-yl)oxycarbonylamino]dodecoxy]-5-oxidanyl-benzoate

Systemtic Name: methyl 3-[12-[(2-methylpropan-2-yl)oxycarbonylamino]dodecoxy]-5-oxidanyl-benzoate Openeye Name: methyl 3-[12-(tert-butoxycarbonylamino)dodecoxy]-5-hydroxy-benzoate CAS Name: 3-hydroxy-5-[12-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]dodecoxy]benzoic acid methyl ester IUPAC Name: methyl 3-hydroxy-5-[12-[(2-methylpropan-2-yl)oxycarbonylamino]dodecoxy]benzoate Traditional Name: 3-[12-(tert-butoxycarbonylamino)dodecoxy]-5-hydroxy-benzoic acid methyl ester Formula: C25H41NO6 MolecularWeight: 451.59614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCCCCCCCCOC1=CC(=CC(=C1)O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCCCCCCCCOC1=CC(=CC(=C1)O)C(=O)OC

InChI

InChI=1S/C25H41NO6/c1-25(2,3)32-24(29)26-15-13-11-9-7-5-6-8-10-12-14-16-31-22-18-20(23(28)30-4)17-21(27)19-22/h17-19,27H,5-16H2,1-4H3,(H,26,29)