(1-oxidanylidene-1-phenyl-pentan-2-yl) 5-[[4-(3,4-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-pentan-2-yl) 5-[[4-(3,4-dimethylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 1-benzoylbutyl 5-[4-(3,4-dimethylphenoxy)anilino]-5-oxo-pentanoate CAS Name: 5-[4-(3,4-dimethylphenoxy)anilino]-5-oxopentanoic acid (1-oxo-1-phenylpentan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpentan-2-yl) 5-[4-(3,4-dimethylphenoxy)anilino]-5-oxopentanoate Traditional Name: 5-[4-(3,4-dimethylphenoxy)anilino]-5-keto-valeric acid 1-benzoylbutyl ester Formula: C30H33NO5 MolecularWeight: 487.58672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H33NO5/c1-4-9-27(30(34)23-10-6-5-7-11-23)36-29(33)13-8-12-28(32)31-24-15-18-25(19-16-24)35-26-17-14-21(2)22(3)20-26/h5-7,10-11,14-20,27H,4,8-9,12-13H2,1-3H3,(H,31,32)