methyl (E)-7-[3-oxidanyl-5-[(4-phenylphenyl)methoxy]-2-piperidin-1-yl-cyclopentyl]hept-4-enoate

Systemtic Name: methyl (E)-7-[3-oxidanyl-5-[(4-phenylphenyl)methoxy]-2-piperidin-1-yl-cyclopentyl]hept-4-enoate Openeye Name: methyl (E)-7-[3-hydroxy-5-[(4-phenylphenyl)methoxy]-2-(1-piperidyl)cyclopentyl]hept-4-enoate CAS Name: (E)-7-[3-hydroxy-5-[(4-phenylphenyl)methoxy]-2-(1-piperidinyl)cyclopentyl]-4-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[3-hydroxy-5-[(4-phenylphenyl)methoxy]-2-piperidin-1-ylcyclopentyl]hept-4-enoate Traditional Name: (E)-7-[3-hydroxy-5-(4-phenylbenzyl)oxy-2-piperidino-cyclopentyl]hept-4-enoic acid methyl ester Formula: C31H41NO4 MolecularWeight: 491.66154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC=CCCC1C(CC(C1N2CCCCC2)O)OCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC/C=C/CCC1C(CC(C1N2CCCCC2)O)OCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H41NO4/c1-35-30(34)15-9-3-2-8-14-27-29(22-28(33)31(27)32-20-10-5-11-21-32)36-23-24-16-18-26(19-17-24)25-12-6-4-7-13-25/h2-4,6-7,12-13,16-19,27-29,31,33H,5,8-11,14-15,20-23H2,1H3/b3-2+