3-[3-(1-hexylcyclobutyl)-3-oxidanyl-propyl]-2-(6-phenylheptyl)cyclopentan-1-one

Systemtic Name: 3-[3-(1-hexylcyclobutyl)-3-oxidanyl-propyl]-2-(6-phenylheptyl)cyclopentan-1-one Openeye Name: 3-[3-(1-hexylcyclobutyl)-3-hydroxy-propyl]-2-(6-phenylheptyl)cyclopentanone CAS Name: 3-[3-(1-hexylcyclobutyl)-3-hydroxypropyl]-2-(6-phenylheptyl)-1-cyclopentanone IUPAC Name: 3-[3-(1-hexylcyclobutyl)-3-hydroxypropyl]-2-(6-phenylheptyl)cyclopentan-1-one Traditional Name: 3-[3-(1-hexylcyclobutyl)-3-hydroxy-propyl]-2-(6-phenylheptyl)cyclopentanone Formula: C31H50O2 MolecularWeight: 454.7275

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(CCC1)C(CCC2CCC(=O)C2CCCCCC(C)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCC1(CCC1)C(CCC2CCC(=O)C2CCCCCC(C)C3=CC=CC=C3)O

InChI

InChI=1S/C31H50O2/c1-3-4-5-12-22-31(23-13-24-31)30(33)21-19-27-18-20-29(32)28(27)17-11-6-8-14-25(2)26-15-9-7-10-16-26/h7,9-10,15-16,25,27-28,30,33H,3-6,8,11-14,17-24H2,1-2H3