1-(oxolan-2-ylmethoxy)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(oxolan-2-ylmethoxy)isoquinoline-3-carboxylic acid Openeye Name: 1-(tetrahydrofuran-2-ylmethoxy)isoquinoline-3-carboxylic acid CAS Name: 1-(2-oxolanylmethoxy)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(oxolan-2-ylmethoxy)isoquinoline-3-carboxylic acid Traditional Name: 1-(tetrahydrofurfuryloxy)isoquinoline-3-carboxylic acid Formula: C15H15NO4 MolecularWeight: 273.2839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC(OC1)COC2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C15H15NO4/c17-15(18)13-8-10-4-1-2-6-12(10)14(16-13)20-9-11-5-3-7-19-11/h1-2,4,6,8,11H,3,5,7,9H2,(H,17,18)