[4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] pentanoate

Systemtic Name: [4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] pentanoate Openeye Name: [4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] pentanoate CAS Name: pentanoic acid [4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] ester IUPAC Name: [4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] pentanoate Traditional Name: valeric acid [4-[4-[4-(2-ethylhexyl)cyclohexyl]phenyl]phenyl] ester Formula: C31H44O2 MolecularWeight: 448.67986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCC

Isomeric SMILES

CCCCC(CC)CC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCC

InChI

InChI=1S/C31H44O2/c1-4-7-9-24(6-3)23-25-11-13-26(14-12-25)27-15-17-28(18-16-27)29-19-21-30(22-20-29)33-31(32)10-8-5-2/h15-22,24-26H,4-14,23H2,1-3H3