[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(butylamino)benzoate

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(butylamino)benzoate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(butylamino)benzoate CAS Name: 2-(butylamino)benzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(butylamino)benzoate Traditional Name: 2-(butylamino)benzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H20BrN3O3 MolecularWeight: 430.2951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCNC1=CC=CC=C1C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3O3/c1-2-3-12-22-17-7-5-4-6-16(17)20(25)26-13-18-23-24-19(27-18)14-8-10-15(21)11-9-14/h4-11,22H,2-3,12-13H2,1H3