(5-methyl-2-propan-2-yl-phenyl) 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: (2-isopropyl-5-methyl-phenyl) 6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-(2-thienyl)cinchoninic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C26H25NO2S MolecularWeight: 415.5472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=CS4

InChI

InChI=1S/C26H25NO2S/c1-15(2)19-9-8-16(3)13-23(19)29-26(28)21-14-22(24-7-6-10-30-24)27-25-18(5)11-17(4)12-20(21)25/h6-15H,1-5H3