(4-benzamidophenyl) 7-[3-(3,3-dimethylbutanoyloxy)-5-oxidanylidene-cyclopenten-1-yl]-6-oxidanylidene-heptanoate

Systemtic Name: (4-benzamidophenyl) 7-[3-(3,3-dimethylbutanoyloxy)-5-oxidanylidene-cyclopenten-1-yl]-6-oxidanylidene-heptanoate Openeye Name: (4-benzamidophenyl) 7-[3-(3,3-dimethylbutanoyloxy)-5-oxo-cyclopenten-1-yl]-6-oxo-heptanoate CAS Name: 7-[3-(3,3-dimethyl-1-oxobutoxy)-5-oxo-1-cyclopentenyl]-6-oxoheptanoic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 7-[3-(3,3-dimethylbutanoyloxy)-5-oxocyclopenten-1-yl]-6-oxoheptanoate Traditional Name: 7-[3-(3,3-dimethylbutanoyloxy)-5-keto-cyclopenten-1-yl]-6-keto-enanthic acid (4-benzamidophenyl) ester Formula: C31H35NO7 MolecularWeight: 533.6121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1CC(=O)C(=C1)CC(=O)CCCCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CC(=O)OC1CC(=O)C(=C1)CC(=O)CCCCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H35NO7/c1-31(2,3)20-29(36)39-26-18-22(27(34)19-26)17-24(33)11-7-8-12-28(35)38-25-15-13-23(14-16-25)32-30(37)21-9-5-4-6-10-21/h4-6,9-10,13-16,18,26H,7-8,11-12,17,19-20H2,1-3H3,(H,32,37)