1-(4-tert-butyl-2-methyl-phenoxy)-3-(3-methoxypropylamino)propan-2-ol; ethanedioic acid

Systemtic Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-(3-methoxypropylamino)propan-2-ol; ethanedioic acid Openeye Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-(3-methoxypropylamino)propan-2-ol; oxalic acid CAS Name: 1-(4-tert-butyl-2-methylphenoxy)-3-(3-methoxypropylamino)-2-propanol; oxalic acid IUPAC Name: 1-(4-tert-butyl-2-methylphenoxy)-3-(3-methoxypropylamino)propan-2-ol; oxalic acid Traditional Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-(3-methoxypropylamino)propan-2-ol; oxalic acid Formula: C20H33NO7 MolecularWeight: 399.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CNCCCOC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CNCCCOC)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H31NO3.C2H2O4/c1-14-11-15(18(2,3)4)7-8-17(14)22-13-16(20)12-19-9-6-10-21-5;3-1(4)2(5)6/h7-8,11,16,19-20H,6,9-10,12-13H2,1-5H3;(H,3,4)(H,5,6)