phenyl 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: phenyl 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: phenyl 6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid phenyl ester IUPAC Name: phenyl 6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-(2-thienyl)cinchoninic acid phenyl ester Formula: C22H17NO2S MolecularWeight: 359.44088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC=C4)C

InChI

InChI=1S/C22H17NO2S/c1-14-11-15(2)21-17(12-14)18(13-19(23-21)20-9-6-10-26-20)22(24)25-16-7-4-3-5-8-16/h3-13H,1-2H3