(2S,3S)-11-(1,3-benzodioxol-5-yl)undec-4-yne-2,3-diol

Systemtic Name: (2S,3S)-11-(1,3-benzodioxol-5-yl)undec-4-yne-2,3-diol Openeye Name: (2S,3S)-11-(1,3-benzodioxol-5-yl)undec-4-yne-2,3-diol CAS Name: (2S,3S)-11-(1,3-benzodioxol-5-yl)-4-undecyne-2,3-diol IUPAC Name: (2S,3S)-11-(1,3-benzodioxol-5-yl)undec-4-yne-2,3-diol Traditional Name: (2S,3S)-11-(1,3-benzodioxol-5-yl)undec-4-yne-2,3-diol Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#CCCCCCCC1=CC2=C(C=C1)OCO2)O)O

Isomeric SMILES

C[C@@H]([C@H](C#CCCCCCCC1=CC2=C(C=C1)OCO2)O)O

InChI

InChI=1S/C18H24O4/c1-14(19)16(20)9-7-5-3-2-4-6-8-15-10-11-17-18(12-15)22-13-21-17/h10-12,14,16,19-20H,2-6,8,13H2,1H3/t14-,16-/m0/s1