(3S,4S)-3-(4-propan-2-ylphenoxy)-4-undecyl-cyclopentan-1-one

Systemtic Name: (3S,4S)-3-(4-propan-2-ylphenoxy)-4-undecyl-cyclopentan-1-one Openeye Name: (3S,4S)-3-(4-isopropylphenoxy)-4-undecyl-cyclopentanone CAS Name: (3S,4S)-3-(4-propan-2-ylphenoxy)-4-undecyl-1-cyclopentanone IUPAC Name: (3S,4S)-3-(4-propan-2-ylphenoxy)-4-undecylcyclopentan-1-one Traditional Name: (3S,4S)-3-(4-isopropylphenoxy)-4-undecyl-cyclopentanone Formula: C25H40O2 MolecularWeight: 372.5839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1CC(=O)CC1OC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCCCCCCCC[C@H]1CC(=O)C[C@@H]1OC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C25H40O2/c1-4-5-6-7-8-9-10-11-12-13-22-18-23(26)19-25(22)27-24-16-14-21(15-17-24)20(2)3/h14-17,20,22,25H,4-13,18-19H2,1-3H3/t22-,25-/m0/s1