2-(2-methyl-1,3-benzothiazol-5-yl)quinoline-4-carboxylic acid

Systemtic Name: 2-(2-methyl-1,3-benzothiazol-5-yl)quinoline-4-carboxylic acid Openeye Name: 2-(2-methyl-1,3-benzothiazol-5-yl)quinoline-4-carboxylic acid CAS Name: 2-(2-methyl-1,3-benzothiazol-5-yl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2-methyl-1,3-benzothiazol-5-yl)quinoline-4-carboxylic acid Traditional Name: 2-(2-methyl-1,3-benzothiazol-5-yl)cinchoninic acid Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C18H12N2O2S/c1-10-19-16-8-11(6-7-17(16)23-10)15-9-13(18(21)22)12-4-2-3-5-14(12)20-15/h2-9H,1H3,(H,21,22)