1-propoxyisoquinoline-3-carboxylic acid

Systemtic Name: 1-propoxyisoquinoline-3-carboxylic acid Openeye Name: 1-propoxyisoquinoline-3-carboxylic acid CAS Name: 1-propoxy-3-isoquinolinecarboxylic acid IUPAC Name: 1-propoxyisoquinoline-3-carboxylic acid Traditional Name: 1-propoxyisoquinoline-3-carboxylic acid Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCOC1=NC(=CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C13H13NO3/c1-2-7-17-12-10-6-4-3-5-9(10)8-11(14-12)13(15)16/h3-6,8H,2,7H2,1H3,(H,15,16)