(3-methoxycarbonylphenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (3-carbomethoxybenzyl) ester Formula: C23H17NO4S MolecularWeight: 403.45038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C23H17NO4S/c1-27-22(25)16-7-4-6-15(12-16)14-28-23(26)18-13-20(21-10-5-11-29-21)24-19-9-3-2-8-17(18)19/h2-13H,14H2,1H3