(4-acetamidophenyl) 7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: (4-acetamidophenyl) 7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: (4-acetamidophenyl) 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoate Traditional Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-keto-cyclopentyl]enanthic acid (4-acetamidophenyl) ester Formula: C29H43NO6 MolecularWeight: 501.65482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)OC2=CC=C(C=C2)NC(=O)C)O)O

Isomeric SMILES

CCCCC(C)(C/C=C/C1C(CC(=O)C1CCCCCCC(=O)OC2=CC=C(C=C2)NC(=O)C)O)O

InChI

InChI=1S/C29H43NO6/c1-4-5-18-29(3,35)19-10-12-25-24(26(32)20-27(25)33)11-8-6-7-9-13-28(34)36-23-16-14-22(15-17-23)30-21(2)31/h10,12,14-17,24-25,27,33,35H,4-9,11,13,18-20H2,1-3H3,(H,30,31)/b12-10+