[5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-chloranylquinoline-4-carboxylate

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-chloranylquinoline-4-carboxylate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 2-chloroquinoline-4-carboxylate CAS Name: 2-chloro-4-quinolinecarboxylic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-chloroquinoline-4-carboxylate Traditional Name: 2-chlorocinchoninic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C21H14ClFN2O3 MolecularWeight: 396.798863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)C2=CC(=NC3=CC=CC=C32)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)C2=CC(=NC3=CC=CC=C32)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14ClFN2O3/c1-12-18(25-28-20(12)13-6-8-14(23)9-7-13)11-27-21(26)16-10-19(22)24-17-5-3-2-4-15(16)17/h2-10H,11H2,1H3