(3-chloranyl-4-methyl-quinolin-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCC3=NC(=NO3)C4=CSC=C4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCC3=NC(=NO3)C4=CSC=C4)Cl

InChI

InChI=1S/C20H16ClN3O3S/c1-12-14-4-2-3-5-15(14)22-16(19(12)21)10-26-18(25)7-6-17-23-20(24-27-17)13-8-9-28-11-13/h2-5,8-9,11H,6-7,10H2,1H3