(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3)Cl)N

InChI

InChI=1S/C15H12ClN3O4S/c1-21-12-5-11(17)10(16)4-9(12)15(20)22-6-13-18-14(19-23-13)8-2-3-24-7-8/h2-5,7H,6,17H2,1H3