(2,3,6-trimethylphenyl) 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoate

Systemtic Name: (2,3,6-trimethylphenyl) 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoate Openeye Name: (2,3,6-trimethylphenyl) 4-(2-oxo-1,3-benzoxazol-3-yl)butanoate CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)butanoic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 4-(2-oxo-1,3-benzoxazol-3-yl)butanoate Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)butyric acid (2,3,6-trimethylphenyl) ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)CCCN2C3=CC=CC=C3OC2=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)CCCN2C3=CC=CC=C3OC2=O)C

InChI

InChI=1S/C20H21NO4/c1-13-10-11-14(2)19(15(13)3)25-18(22)9-6-12-21-16-7-4-5-8-17(16)24-20(21)23/h4-5,7-8,10-11H,6,9,12H2,1-3H3