(E)-7-[5-[(4-dimethylaminophenyl)methoxy]-2-morpholin-4-yl-3-oxidanylidene-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[5-[(4-dimethylaminophenyl)methoxy]-2-morpholin-4-yl-3-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[5-[(4-dimethylaminophenyl)methoxy]-2-morpholino-3-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[5-[(4-dimethylaminophenyl)methoxy]-2-(4-morpholinyl)-3-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[5-[(4-dimethylaminophenyl)methoxy]-2-morpholin-4-yl-3-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[5-[4-(dimethylamino)benzyl]oxy-3-keto-2-morpholino-cyclopentyl]hept-5-enoic acid Formula: C25H36N2O5 MolecularWeight: 444.56374

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)COC2CC(=O)C(C2CC=CCCCC(=O)O)N3CCOCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)COC2CC(=O)C(C2C/C=C/CCCC(=O)O)N3CCOCC3

InChI

InChI=1S/C25H36N2O5/c1-26(2)20-11-9-19(10-12-20)18-32-23-17-22(28)25(27-13-15-31-16-14-27)21(23)7-5-3-4-6-8-24(29)30/h3,5,9-12,21,23,25H,4,6-8,13-18H2,1-2H3,(H,29,30)/b5-3+