1-(tert-butylamino)-3-(2-prop-2-ynoxyphenoxy)propan-2-ol; ethanedioic acid

Systemtic Name: 1-(tert-butylamino)-3-(2-prop-2-ynoxyphenoxy)propan-2-ol; ethanedioic acid Openeye Name: 1-(tert-butylamino)-3-(2-prop-2-ynoxyphenoxy)propan-2-ol; oxalic acid CAS Name: 1-(tert-butylamino)-3-(2-prop-2-ynoxyphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-(tert-butylamino)-3-(2-prop-2-ynoxyphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-(tert-butylamino)-3-(2-propargyloxyphenoxy)propan-2-ol; oxalic acid Formula: C18H25NO7 MolecularWeight: 367.3936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1OCC#C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1OCC#C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23NO3.C2H2O4/c1-5-10-19-14-8-6-7-9-15(14)20-12-13(18)11-17-16(2,3)4;3-1(4)2(5)6/h1,6-9,13,17-18H,10-12H2,2-4H3;(H,3,4)(H,5,6)