(1-oxidanylidene-1-phenyl-butan-2-yl) 4-[[4-(2,6-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 4-[[4-(2,6-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 1-benzoylpropyl 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxo-butanoate CAS Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxobutanoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxobutanoate Traditional Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-keto-butyric acid 1-benzoylpropyl ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=C(C=CC=C3C)C

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=C(C=CC=C3C)C

InChI

InChI=1S/C28H29NO5/c1-4-24(27(32)21-11-6-5-7-12-21)34-26(31)18-17-25(30)29-22-13-15-23(16-14-22)33-28-19(2)9-8-10-20(28)3/h5-16,24H,4,17-18H2,1-3H3,(H,29,30)