[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 7-chloranyl-8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenyl-propan-2-yl] 7-chloranyl-8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-phenyl-ethyl] 7-chloro-8-methyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 7-chloro-8-methyl-2-thiophen-2-yl-4-quinolinecarboxylic acid [(2R)-1-oxo-1-phenylpropan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-phenylpropan-2-yl] 7-chloro-8-methyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 7-chloro-8-methyl-2-(2-thienyl)cinchoninic acid [(1R)-2-keto-1-methyl-2-phenyl-ethyl] ester Formula: C24H18ClNO3S MolecularWeight: 435.92262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)O[C@H](C)C(=O)C3=CC=CC=C3)C4=CC=CS4)Cl

InChI

InChI=1S/C24H18ClNO3S/c1-14-19(25)11-10-17-18(13-20(26-22(14)17)21-9-6-12-30-21)24(28)29-15(2)23(27)16-7-4-3-5-8-16/h3-13,15H,1-2H3/t15-/m1/s1