naphthalen-1-ylmethyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: 1-naphthylmethyl 2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: 2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-chloro-2-thienyl)cinchoninic acid 1-naphthylmethyl ester Formula: C25H16ClNO2S MolecularWeight: 429.91804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

InChI

InChI=1S/C25H16ClNO2S/c26-24-13-12-23(30-24)22-14-20(19-10-3-4-11-21(19)27-22)25(28)29-15-17-8-5-7-16-6-1-2-9-18(16)17/h1-14H,15H2