(2,6-dimethylphenyl) 2-ethyl-5-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate

Systemtic Name: (2,6-dimethylphenyl) 2-ethyl-5-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate Openeye Name: (2,6-dimethylphenyl) 2-ethyl-5-[2-(methylamino)-4-oxo-5-phenyl-3-furyl]benzoate CAS Name: 2-ethyl-5-[2-(methylamino)-4-oxo-5-phenyl-3-furanyl]benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-ethyl-5-[2-(methylamino)-4-oxo-5-phenylfuran-3-yl]benzoate Traditional Name: 2-ethyl-5-[4-keto-2-(methylamino)-5-phenyl-3-furyl]benzoic acid (2,6-dimethylphenyl) ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=C(OC(C2=O)C3=CC=CC=C3)NC)C(=O)OC4=C(C=CC=C4C)C

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=C(OC(C2=O)C3=CC=CC=C3)NC)C(=O)OC4=C(C=CC=C4C)C

InChI

InChI=1S/C28H27NO4/c1-5-19-14-15-21(16-22(19)28(31)33-25-17(2)10-9-11-18(25)3)23-24(30)26(32-27(23)29-4)20-12-7-6-8-13-20/h6-16,26,29H,5H2,1-4H3