ethanedioic acid; 3-[2-(4-methoxy-3-phenethyloxy-phenyl)ethyl-propyl-amino]propan-1-ol

Systemtic Name: ethanedioic acid; 3-[2-(4-methoxy-3-phenethyloxy-phenyl)ethyl-propyl-amino]propan-1-ol Openeye Name: 3-[2-(4-methoxy-3-phenethyloxy-phenyl)ethyl-propyl-amino]propan-1-ol; oxalic acid CAS Name: 3-[2-(4-methoxy-3-phenethyloxyphenyl)ethyl-propylamino]-1-propanol; oxalic acid IUPAC Name: 3-[2-(4-methoxy-3-phenethyloxyphenyl)ethyl-propylamino]propan-1-ol; oxalic acid Traditional Name: 3-[2-(4-methoxy-3-phenethyloxy-phenyl)ethyl-propyl-amino]propan-1-ol; oxalic acid Formula: C25H35NO7 MolecularWeight: 461.5479

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCO)CCC1=CC(=C(C=C1)OC)OCCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN(CCCO)CCC1=CC(=C(C=C1)OC)OCCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H33NO3.C2H2O4/c1-3-14-24(15-7-17-25)16-12-21-10-11-22(26-2)23(19-21)27-18-13-20-8-5-4-6-9-20;3-1(4)2(5)6/h4-6,8-11,19,25H,3,7,12-18H2,1-2H3;(H,3,4)(H,5,6)