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

Systemtic Name: 2-(azocan-1-yl)quinoline-4-carboxylic acid Openeye Name: 2-(azocan-1-yl)quinoline-4-carboxylic acid CAS Name: 2-(1-azocanyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(azocan-1-yl)quinoline-4-carboxylic acid Traditional Name: 2-(azocan-1-yl)cinchoninic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

C1CCCN(CCC1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C17H20N2O2/c20-17(21)14-12-16(18-15-9-5-4-8-13(14)15)19-10-6-2-1-3-7-11-19/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,20,21)