(7E)-7-[cyclohexyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminooctanoic acid

Systemtic Name: (7E)-7-[cyclohexyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminooctanoic acid Openeye Name: (7E)-7-[cyclohexyl-[4-(2-quinolylmethoxy)phenyl]methoxy]iminooctanoic acid CAS Name: (7E)-7-[cyclohexyl-[4-(2-quinolinylmethoxy)phenyl]methoxy]iminooctanoic acid IUPAC Name: (7E)-7-[cyclohexyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminooctanoic acid Traditional Name: (7E)-7-[cyclohexyl-[4-(2-quinolylmethoxy)phenyl]methyl]oximinocaprylic acid Formula: C31H38N2O4 MolecularWeight: 502.64442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(C1CCCCC1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CCCCCC(=O)O

Isomeric SMILES

C/C(=N\OC(C1CCCCC1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)/CCCCCC(=O)O

InChI

InChI=1S/C31H38N2O4/c1-23(10-4-2-7-15-30(34)35)33-37-31(25-12-5-3-6-13-25)26-17-20-28(21-18-26)36-22-27-19-16-24-11-8-9-14-29(24)32-27/h8-9,11,14,16-21,25,31H,2-7,10,12-13,15,22H2,1H3,(H,34,35)/b33-23+