3-(4-cyclopentyloxy-3-isoquinolin-6-yl-phenyl)propanoic acid

Systemtic Name: 3-(4-cyclopentyloxy-3-isoquinolin-6-yl-phenyl)propanoic acid Openeye Name: 3-[4-(cyclopentoxy)-3-(6-isoquinolyl)phenyl]propanoic acid CAS Name: 3-[4-cyclopentyloxy-3-(6-isoquinolinyl)phenyl]propanoic acid IUPAC Name: 3-(4-cyclopentyloxy-3-isoquinolin-6-ylphenyl)propanoic acid Traditional Name: 3-[4-(cyclopentoxy)-3-(6-isoquinolyl)phenyl]propionic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)C=NC=C4

Isomeric SMILES

C1CCC(C1)OC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)C=NC=C4

InChI

InChI=1S/C23H23NO3/c25-23(26)10-6-16-5-9-22(27-20-3-1-2-4-20)21(13-16)18-7-8-19-15-24-12-11-17(19)14-18/h5,7-9,11-15,20H,1-4,6,10H2,(H,25,26)