(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: 2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-chloro-2-thienyl)cinchoninic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C28H16ClNO4S MolecularWeight: 497.94894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(S6)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(S6)Cl

InChI

InChI=1S/C28H16ClNO4S/c29-25-12-11-24(35-25)22-14-20(19-7-3-4-8-21(19)30-22)28(32)33-15-17-13-26(31)34-23-10-9-16-5-1-2-6-18(16)27(17)23/h1-14H,15H2