7-[4-(quinolin-4-ylmethyl)phenyl]heptanoic acid

Systemtic Name: 7-[4-(quinolin-4-ylmethyl)phenyl]heptanoic acid Openeye Name: 7-[4-(4-quinolylmethyl)phenyl]heptanoic acid CAS Name: 7-[4-(4-quinolinylmethyl)phenyl]heptanoic acid IUPAC Name: 7-[4-(quinolin-4-ylmethyl)phenyl]heptanoic acid Traditional Name: 7-[4-(4-quinolylmethyl)phenyl]enanthic acid Formula: C23H25NO2 MolecularWeight: 347.4501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)CC3=CC=C(C=C3)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)CC3=CC=C(C=C3)CCCCCCC(=O)O

InChI

InChI=1S/C23H25NO2/c25-23(26)10-4-2-1-3-7-18-11-13-19(14-12-18)17-20-15-16-24-22-9-6-5-8-21(20)22/h5-6,8-9,11-16H,1-4,7,10,17H2,(H,25,26)