tert-butyl 3-tert-butyl-6-[[4-[cyclopropylcarbonyl(methyl)amino]phenoxy]methyl]-2-oxidanyl-benzoate

Systemtic Name: tert-butyl 3-tert-butyl-6-[[4-[cyclopropylcarbonyl(methyl)amino]phenoxy]methyl]-2-oxidanyl-benzoate Openeye Name: tert-butyl 3-tert-butyl-6-[[4-[cyclopropanecarbonyl(methyl)amino]phenoxy]methyl]-2-hydroxy-benzoate CAS Name: 3-tert-butyl-6-[[4-[[cyclopropyl(oxo)methyl]-methylamino]phenoxy]methyl]-2-hydroxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-tert-butyl-6-[[4-[cyclopropanecarbonyl(methyl)amino]phenoxy]methyl]-2-hydroxybenzoate Traditional Name: 3-tert-butyl-6-[[4-[cyclopropanecarbonyl(methyl)amino]phenoxy]methyl]-2-hydroxy-benzoic acid tert-butyl ester Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)COC2=CC=C(C=C2)N(C)C(=O)C3CC3)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)COC2=CC=C(C=C2)N(C)C(=O)C3CC3)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C27H35NO5/c1-26(2,3)21-15-10-18(22(23(21)29)25(31)33-27(4,5)6)16-32-20-13-11-19(12-14-20)28(7)24(30)17-8-9-17/h10-15,17,29H,8-9,16H2,1-7H3