(4,5-dimethoxy-2-methyl-phenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C24H21NO4S MolecularWeight: 419.49284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)OC)OC

InChI

InChI=1S/C24H21NO4S/c1-15-11-21(27-2)22(28-3)12-16(15)14-29-24(26)18-13-20(23-9-6-10-30-23)25-19-8-5-4-7-17(18)19/h4-13H,14H2,1-3H3