1,3-benzothiazol-2-ylmethyl quinoline-2-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl quinoline-2-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl quinoline-2-carboxylate Traditional Name: quinaldic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H12N2O2S/c21-18(15-10-9-12-5-1-2-6-13(12)19-15)22-11-17-20-14-7-3-4-8-16(14)23-17/h1-10H,11H2