6-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]pyridine-2-carboxylic acid

Systemtic Name: 6-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]pyridine-2-carboxylic acid Openeye Name: 6-[2-(2-benzyloxy-5-methyl-phenyl)cyclopenten-1-yl]pyridine-2-carboxylic acid CAS Name: 6-[2-(5-methyl-2-phenylmethoxyphenyl)-1-cyclopentenyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[2-(5-methyl-2-phenylmethoxyphenyl)cyclopenten-1-yl]pyridine-2-carboxylic acid Traditional Name: 6-[2-(2-benzoxy-5-methyl-phenyl)cyclopenten-1-yl]picolinic acid Formula: C25H23NO3 MolecularWeight: 385.45502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(CCC3)C4=NC(=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(CCC3)C4=NC(=CC=C4)C(=O)O

InChI

InChI=1S/C25H23NO3/c1-17-13-14-24(29-16-18-7-3-2-4-8-18)21(15-17)19-9-5-10-20(19)22-11-6-12-23(26-22)25(27)28/h2-4,6-8,11-15H,5,9-10,16H2,1H3,(H,27,28)