(2E)-2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]prop-2-enoxyimino]propanoic acid

Systemtic Name: (2E)-2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]prop-2-enoxyimino]propanoic acid Openeye Name: (2E)-2-[3,3-bis[4-(2-quinolylmethoxy)phenyl]allyloxyimino]propanoic acid CAS Name: (2E)-2-[3,3-bis[4-(2-quinolinylmethoxy)phenyl]prop-2-enoxyimino]propanoic acid IUPAC Name: (2E)-2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]prop-2-enoxyimino]propanoic acid Traditional Name: (2E)-2-[3,3-bis[4-(2-quinolylmethoxy)phenyl]allyloximino]propionic acid Formula: C38H31N3O5 MolecularWeight: 609.66984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOCC=C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)C(=O)O

Isomeric SMILES

C/C(=N\OCC=C(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)/C(=O)O

InChI

InChI=1S/C38H31N3O5/c1-26(38(42)43)41-46-23-22-35(27-12-18-33(19-13-27)44-24-31-16-10-29-6-2-4-8-36(29)39-31)28-14-20-34(21-15-28)45-25-32-17-11-30-7-3-5-9-37(30)40-32/h2-22H,23-25H2,1H3,(H,42,43)/b41-26+