(2E)-2-[2-adamantyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminoethanoic acid

Systemtic Name: (2E)-2-[2-adamantyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminoethanoic acid Openeye Name: (2E)-2-[2-adamantyl-[4-(2-quinolylmethoxy)phenyl]methoxy]iminoacetic acid CAS Name: (2E)-2-[2-adamantyl-[4-(2-quinolinylmethoxy)phenyl]methoxy]iminoacetic acid IUPAC Name: (2E)-2-[2-adamantyl-[4-(quinolin-2-ylmethoxy)phenyl]methoxy]iminoacetic acid Traditional Name: (2E)-2-[2-adamantyl-[4-(2-quinolylmethoxy)phenyl]methyl]oximinoacetic acid Formula: C29H30N2O4 MolecularWeight: 470.5595

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)ON=CC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)O/N=C/C(=O)O

InChI

InChI=1S/C29H30N2O4/c32-27(33)16-30-35-29(28-22-12-18-11-19(14-22)15-23(28)13-18)21-6-9-25(10-7-21)34-17-24-8-5-20-3-1-2-4-26(20)31-24/h1-10,16,18-19,22-23,28-29H,11-15,17H2,(H,32,33)/b30-16+