2-[4-(2-chloranylpropanoylamino)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-(2-chloranylpropanoylamino)phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-(2-chloropropanoylamino)phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[(2-chloro-1-oxopropyl)amino]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-(2-chloropropanoylamino)phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-(2-chloropropanoylamino)phenyl]cinchoninic acid Formula: C19H15ClN2O3 MolecularWeight: 354.787

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O)Cl

InChI

InChI=1S/C19H15ClN2O3/c1-11(20)18(23)21-13-8-6-12(7-9-13)17-10-15(19(24)25)14-4-2-3-5-16(14)22-17/h2-11H,1H3,(H,21,23)(H,24,25)