tert-butyl (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-piperidin-1-yl-cyclopentyl]oxyhex-4-enoate

Systemtic Name: tert-butyl (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-piperidin-1-yl-cyclopentyl]oxyhex-4-enoate Openeye Name: tert-butyl (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-(1-piperidyl)cyclopentoxy]hex-4-enoate CAS Name: (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-(1-piperidinyl)cyclopentyl]oxy-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-piperidin-1-ylcyclopentyl]oxyhex-4-enoate Traditional Name: (E)-6-[2-[3-(4-phenylphenyl)propoxy]-5-piperidino-cyclopentoxy]hex-4-enoic acid tert-butyl ester Formula: C35H49NO4 MolecularWeight: 547.76786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC=CCOC1C(CCC1OCCCC2=CC=C(C=C2)C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)CC/C=C/COC1C(CCC1OCCCC2=CC=C(C=C2)C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C35H49NO4/c1-35(2,3)40-33(37)17-9-5-12-26-39-34-31(36-24-10-6-11-25-36)22-23-32(34)38-27-13-14-28-18-20-30(21-19-28)29-15-7-4-8-16-29/h4-5,7-8,12,15-16,18-21,31-32,34H,6,9-11,13-14,17,22-27H2,1-3H3/b12-5+