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

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylquinoline-4-carboxylate Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H14ClN3O3 MolecularWeight: 379.79646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14ClN3O3/c1-12-10-16(15-4-2-3-5-17(15)22-12)20(25)26-11-18-23-19(24-27-18)13-6-8-14(21)9-7-13/h2-10H,11H2,1H3