[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=NN=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O3/c1-13(2)19-11-17(16-5-3-4-6-18(16)24-19)22(27)28-12-20-25-26-21(29-20)14-7-9-15(23)10-8-14/h3-11,13H,12H2,1-2H3