4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid

Systemtic Name: 4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid Openeye Name: 4-[[3-(2-quinolylmethoxy)phenyl]methoxymethyl]benzoic acid CAS Name: 4-[[3-(2-quinolinylmethoxy)phenyl]methoxymethyl]benzoic acid IUPAC Name: 4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid Traditional Name: 4-[[3-(2-quinolylmethoxy)benzyl]oxymethyl]benzoic acid Formula: C25H21NO4 MolecularWeight: 399.43854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)COCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)COCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H21NO4/c27-25(28)21-10-8-18(9-11-21)15-29-16-19-4-3-6-23(14-19)30-17-22-13-12-20-5-1-2-7-24(20)26-22/h1-14H,15-17H2,(H,27,28)