2-(azepan-1-yl)quinoline-4-carboxylic acid

Systemtic Name: 2-(azepan-1-yl)quinoline-4-carboxylic acid Openeye Name: 2-(azepan-1-yl)quinoline-4-carboxylic acid CAS Name: 2-(1-azepanyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(azepan-1-yl)quinoline-4-carboxylic acid Traditional Name: 2-(azepan-1-yl)cinchoninic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

C1CCCN(CC1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c19-16(20)13-11-15(18-9-5-1-2-6-10-18)17-14-8-4-3-7-12(13)14/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,19,20)