2-(cycloheptylamino)quinoline-4-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

C1CCCC(CC1)NC2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C17H20N2O2/c20-17(21)14-11-16(18-12-7-3-1-2-4-8-12)19-15-10-6-5-9-13(14)15/h5-6,9-12H,1-4,7-8H2,(H,18,19)(H,20,21)