(2E)-2-[2-butyl-1-[4-(quinolin-2-ylmethoxy)phenyl]hexoxy]iminoethanoic acid

Systemtic Name: (2E)-2-[2-butyl-1-[4-(quinolin-2-ylmethoxy)phenyl]hexoxy]iminoethanoic acid Openeye Name: (2E)-2-[2-butyl-1-[4-(2-quinolylmethoxy)phenyl]hexoxy]iminoacetic acid CAS Name: (2E)-2-[2-butyl-1-[4-(2-quinolinylmethoxy)phenyl]hexoxy]iminoacetic acid IUPAC Name: (2E)-2-[2-butyl-1-[4-(quinolin-2-ylmethoxy)phenyl]hexoxy]iminoacetic acid Traditional Name: (2E)-2-[2-butyl-1-[4-(2-quinolylmethoxy)phenyl]hexyl]oximinoacetic acid Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)ON=CC(=O)O

Isomeric SMILES

CCCCC(CCCC)C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)O/N=C/C(=O)O

InChI

InChI=1S/C28H34N2O4/c1-3-5-9-22(10-6-4-2)28(34-29-19-27(31)32)23-14-17-25(18-15-23)33-20-24-16-13-21-11-7-8-12-26(21)30-24/h7-8,11-19,22,28H,3-6,9-10,20H2,1-2H3,(H,31,32)/b29-19+