(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate CAS Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate Traditional Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butyric acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C24H21N3O6 MolecularWeight: 447.44004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O6/c1-15(28)25-18-10-11-19-17(12-23(30)32-20(19)13-18)14-31-22(29)9-5-8-21-26-24(27-33-21)16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14H2,1H3,(H,25,28)