(3S,4S)-3-(hydroxymethyl)-4-[2-(3-nonylphenyl)ethyl]oxetan-2-one

Systemtic Name: (3S,4S)-3-(hydroxymethyl)-4-[2-(3-nonylphenyl)ethyl]oxetan-2-one Openeye Name: (3S,4S)-3-(hydroxymethyl)-4-[2-(3-nonylphenyl)ethyl]oxetan-2-one CAS Name: (3S,4S)-3-(hydroxymethyl)-4-[2-(3-nonylphenyl)ethyl]-2-oxetanone IUPAC Name: (3S,4S)-3-(hydroxymethyl)-4-[2-(3-nonylphenyl)ethyl]oxetan-2-one Traditional Name: (3S,4S)-3-methylol-4-[2-(3-nonylphenyl)ethyl]oxetan-2-one Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC(=C1)CCC2C(C(=O)O2)CO

Isomeric SMILES

CCCCCCCCCC1=CC=CC(=C1)CC[C@H]2[C@@H](C(=O)O2)CO

InChI

InChI=1S/C21H32O3/c1-2-3-4-5-6-7-8-10-17-11-9-12-18(15-17)13-14-20-19(16-22)21(23)24-20/h9,11-12,15,19-20,22H,2-8,10,13-14,16H2,1H3/t19-,20-/m0/s1