thiophen-2-ylmethyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: thiophen-2-ylmethyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Openeye Name: 2-thienylmethyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxylic acid thiophen-2-ylmethyl ester IUPAC Name: thiophen-2-ylmethyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4,5-trimethoxyphenyl)cinchoninic acid 2-thenyl ester Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CS4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CS4

InChI

InChI=1S/C24H21NO5S/c1-27-21-11-15(12-22(28-2)23(21)29-3)20-13-18(17-8-4-5-9-19(17)25-20)24(26)30-14-16-7-6-10-31-16/h4-13H,14H2,1-3H3