2-(4-methylpentan-2-ylamino)quinoline-4-carboxylic acid

Systemtic Name: 2-(4-methylpentan-2-ylamino)quinoline-4-carboxylic acid Openeye Name: 2-(1,3-dimethylbutylamino)quinoline-4-carboxylic acid CAS Name: 2-(4-methylpentan-2-ylamino)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-methylpentan-2-ylamino)quinoline-4-carboxylic acid Traditional Name: 2-(1,3-dimethylbutylamino)cinchoninic acid Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)NC1=NC2=CC=CC=C2C(=C1)C(=O)O

Isomeric SMILES

CC(C)CC(C)NC1=NC2=CC=CC=C2C(=C1)C(=O)O

InChI

InChI=1S/C16H20N2O2/c1-10(2)8-11(3)17-15-9-13(16(19)20)12-6-4-5-7-14(12)18-15/h4-7,9-11H,8H2,1-3H3,(H,17,18)(H,19,20)