(2E)-2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]iminopropanoic acid

Systemtic Name: (2E)-2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]iminopropanoic acid Openeye Name: (2E)-2-[3-methyl-3-phenyl-1-[4-(2-quinolylmethoxy)phenyl]butoxy]iminopropanoic acid CAS Name: (2E)-2-[3-methyl-3-phenyl-1-[4-(2-quinolinylmethoxy)phenyl]butoxy]iminopropanoic acid IUPAC Name: (2E)-2-[3-methyl-3-phenyl-1-[4-(quinolin-2-ylmethoxy)phenyl]butoxy]iminopropanoic acid Traditional Name: (2E)-2-[3-methyl-3-phenyl-1-[4-(2-quinolylmethoxy)phenyl]butyl]oximinopropionic acid Formula: C30H30N2O4 MolecularWeight: 482.5702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(CC(C)(C)C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

C/C(=N\OC(CC(C)(C)C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)/C(=O)O

InChI

InChI=1S/C30H30N2O4/c1-21(29(33)34)32-36-28(19-30(2,3)24-10-5-4-6-11-24)23-14-17-26(18-15-23)35-20-25-16-13-22-9-7-8-12-27(22)31-25/h4-18,28H,19-20H2,1-3H3,(H,33,34)/b32-21+