1-(2-tert-butyl-4-methoxy-phenoxy)-3-(cyclopentylamino)propan-2-ol; ethanedioic acid

Systemtic Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-(cyclopentylamino)propan-2-ol; ethanedioic acid Openeye Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-(cyclopentylamino)propan-2-ol; oxalic acid CAS Name: 1-(2-tert-butyl-4-methoxyphenoxy)-3-(cyclopentylamino)-2-propanol; oxalic acid IUPAC Name: 1-(2-tert-butyl-4-methoxyphenoxy)-3-(cyclopentylamino)propan-2-ol; oxalic acid Traditional Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-(cyclopentylamino)propan-2-ol; oxalic acid Formula: C21H33NO7 MolecularWeight: 411.48922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OC)OCC(CNC2CCCC2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OC)OCC(CNC2CCCC2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31NO3.C2H2O4/c1-19(2,3)17-11-16(22-4)9-10-18(17)23-13-15(21)12-20-14-7-5-6-8-14;3-1(4)2(5)6/h9-11,14-15,20-21H,5-8,12-13H2,1-4H3;(H,3,4)(H,5,6)