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

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 3-(4-butyl-3-oxo-quinoxalin-2-yl)propanoate CAS Name: 3-(4-butyl-3-oxo-2-quinoxalinyl)propanoic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-(4-butyl-3-oxoquinoxalin-2-yl)propanoate Traditional Name: 3-(4-butyl-3-keto-quinoxalin-2-yl)propionic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=C(OC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=C(OC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H27N3O4/c1-3-4-16-29-23-13-9-8-12-20(23)27-21(26(29)31)14-15-24(30)32-17-22-18(2)33-25(28-22)19-10-6-5-7-11-19/h5-13H,3-4,14-17H2,1-2H3