1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)propan-2-ol; ethanedioic acid Openeye Name: 1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)propan-2-ol; oxalic acid CAS Name: 1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)-2-propanol; oxalic acid IUPAC Name: 1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)propan-2-ol; oxalic acid Traditional Name: 1-[bis(4-methoxyphenyl)methoxy]-3-(phenethylamino)propan-2-ol; oxalic acid Formula: C28H33NO8 MolecularWeight: 511.56352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)OCC(CNCCC3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)OCC(CNCCC3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H31NO4.C2H2O4/c1-29-24-12-8-21(9-13-24)26(22-10-14-25(30-2)15-11-22)31-19-23(28)18-27-17-16-20-6-4-3-5-7-20;3-1(4)2(5)6/h3-15,23,26-28H,16-19H2,1-2H3;(H,3,4)(H,5,6)