[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate CAS Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoic acid [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionic acid [2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl] ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)COC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O4/c1-26(2)18-10-8-16(9-11-18)14-23-19(27)15-29-21(28)13-12-20-24-22(25-30-20)17-6-4-3-5-7-17/h3-11H,12-15H2,1-2H3,(H,23,27)