4-[3-[2-tert-butyl-4-(diethylcarbamoyl)-3-methyl-phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxamide

Systemtic Name: 4-[3-[2-tert-butyl-4-(diethylcarbamoyl)-3-methyl-phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxamide Openeye Name: 4-[3-[2-tert-butyl-4-(diethylcarbamoyl)-3-methyl-phenoxy]-2-hydroxy-propyl]piperazine-1-carboxamide CAS Name: 4-[3-[2-tert-butyl-4-[diethylamino(oxo)methyl]-3-methylphenoxy]-2-hydroxypropyl]-1-piperazinecarboxamide IUPAC Name: 4-[3-[2-tert-butyl-4-(diethylcarbamoyl)-3-methylphenoxy]-2-hydroxypropyl]piperazine-1-carboxamide Traditional Name: 4-[3-[2-tert-butyl-4-(diethylcarbamoyl)-3-methyl-phenoxy]-2-hydroxy-propyl]piperazine-1-carboxamide Formula: C24H40N4O4 MolecularWeight: 448.5988

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(C=C1)OCC(CN2CCN(CC2)C(=O)N)O)C(C)(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(C=C1)OCC(CN2CCN(CC2)C(=O)N)O)C(C)(C)C)C

InChI

InChI=1S/C24H40N4O4/c1-7-27(8-2)22(30)19-9-10-20(21(17(19)3)24(4,5)6)32-16-18(29)15-26-11-13-28(14-12-26)23(25)31/h9-10,18,29H,7-8,11-16H2,1-6H3,(H2,25,31)