phenacyl 7-chloranyl-8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: phenacyl 7-chloranyl-8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: phenacyl 7-chloro-8-methyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 7-chloro-8-methyl-2-thiophen-2-yl-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 7-chloro-8-methyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 7-chloro-8-methyl-2-(2-thienyl)cinchoninic acid phenacyl ester Formula: C23H16ClNO3S MolecularWeight: 421.89604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CS4)Cl

InChI

InChI=1S/C23H16ClNO3S/c1-14-18(24)10-9-16-17(12-19(25-22(14)16)21-8-5-11-29-21)23(27)28-13-20(26)15-6-3-2-4-7-15/h2-12H,13H2,1H3