(1-oxidanylidene-1-phenyl-propan-2-yl) 5-[[4-(2,6-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 5-[[4-(2,6-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 5-[4-(2,6-dimethylphenoxy)anilino]-5-oxo-pentanoate CAS Name: 5-[4-(2,6-dimethylphenoxy)anilino]-5-oxopentanoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 5-[4-(2,6-dimethylphenoxy)anilino]-5-oxopentanoate Traditional Name: 5-[4-(2,6-dimethylphenoxy)anilino]-5-keto-valeric acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)NC(=O)CCCC(=O)OC(C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)NC(=O)CCCC(=O)OC(C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H29NO5/c1-19-9-7-10-20(2)28(19)34-24-17-15-23(16-18-24)29-25(30)13-8-14-26(31)33-21(3)27(32)22-11-5-4-6-12-22/h4-7,9-12,15-18,21H,8,13-14H2,1-3H3,(H,29,30)