tert-butyl (E)-6-[2-[(4-phenylphenyl)methoxy]-5-piperidin-1-yl-cyclopentyl]oxyhex-4-enoate

Systemtic Name: tert-butyl (E)-6-[2-[(4-phenylphenyl)methoxy]-5-piperidin-1-yl-cyclopentyl]oxyhex-4-enoate Openeye Name: tert-butyl (E)-6-[2-[(4-phenylphenyl)methoxy]-5-(1-piperidyl)cyclopentoxy]hex-4-enoate CAS Name: (E)-6-[2-[(4-phenylphenyl)methoxy]-5-(1-piperidinyl)cyclopentyl]oxy-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-6-[2-[(4-phenylphenyl)methoxy]-5-piperidin-1-ylcyclopentyl]oxyhex-4-enoate Traditional Name: (E)-6-[2-(4-phenylbenzyl)oxy-5-piperidino-cyclopentoxy]hex-4-enoic acid tert-butyl ester Formula: C33H45NO4 MolecularWeight: 519.7147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC=CCOC1C(CCC1OCC2=CC=C(C=C2)C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)CC/C=C/COC1C(CCC1OCC2=CC=C(C=C2)C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C33H45NO4/c1-33(2,3)38-31(35)15-9-5-12-24-36-32-29(34-22-10-6-11-23-34)20-21-30(32)37-25-26-16-18-28(19-17-26)27-13-7-4-8-14-27/h4-5,7-8,12-14,16-19,29-30,32H,6,9-11,15,20-25H2,1-3H3/b12-5+