4-azanyl-8-propyl-cinnoline-3-carboxylic acid

Systemtic Name: 4-azanyl-8-propyl-cinnoline-3-carboxylic acid Openeye Name: 4-amino-8-propyl-cinnoline-3-carboxylic acid CAS Name: 4-amino-8-propyl-3-cinnolinecarboxylic acid IUPAC Name: 4-amino-8-propylcinnoline-3-carboxylic acid Traditional Name: 4-amino-8-propyl-cinnoline-3-carboxylic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1N=NC(=C2N)C(=O)O

Isomeric SMILES

CCCC1=CC=CC2=C1N=NC(=C2N)C(=O)O

InChI

InChI=1S/C12H13N3O2/c1-2-4-7-5-3-6-8-9(13)11(12(16)17)15-14-10(7)8/h3,5-6H,2,4H2,1H3,(H2,13,14)(H,16,17)