(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylquinoline-4-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylquinoline-4-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3/c1-14-19(15(2)27-24-14)13-26-22(25)18-12-21(16-8-4-3-5-9-16)23-20-11-7-6-10-17(18)20/h3-12H,13H2,1-2H3