(1-oxidanylidene-1-phenyl-pentan-2-yl) 4-[[4-(2,5-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-pentan-2-yl) 4-[[4-(2,5-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 1-benzoylbutyl 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxo-butanoate CAS Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxobutanoic acid (1-oxo-1-phenylpentan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpentan-2-yl) 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxobutanoate Traditional Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-keto-butyric acid 1-benzoylbutyl ester Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCC(C(=O)C1=CC=CC=C1)OC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C29H31NO5/c1-4-8-25(29(33)22-9-6-5-7-10-22)35-28(32)18-17-27(31)30-23-13-15-24(16-14-23)34-26-19-20(2)11-12-21(26)3/h5-7,9-16,19,25H,4,8,17-18H2,1-3H3,(H,30,31)