(3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 3-(4-butyl-3-oxo-quinoxalin-2-yl)propanoate CAS Name: 3-(4-butyl-3-oxo-2-quinoxalinyl)propanoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-(4-butyl-3-oxoquinoxalin-2-yl)propanoate Traditional Name: 3-(4-butyl-3-keto-quinoxalin-2-yl)propionic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=C(ON=C3C)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=C(ON=C3C)C

InChI

InChI=1S/C21H25N3O4/c1-4-5-12-24-19-9-7-6-8-17(19)22-18(21(24)26)10-11-20(25)27-13-16-14(2)23-28-15(16)3/h6-9H,4-5,10-13H2,1-3H3