(1S,2S)-2-azanyl-1-[4-[(E)-dodec-1-enyl]thiophen-2-yl]propane-1,3-diol

Systemtic Name: (1S,2S)-2-azanyl-1-[4-[(E)-dodec-1-enyl]thiophen-2-yl]propane-1,3-diol Openeye Name: (1S,2S)-2-amino-1-[4-[(E)-dodec-1-enyl]-2-thienyl]propane-1,3-diol CAS Name: (1S,2S)-2-amino-1-[4-[(E)-dodec-1-enyl]-2-thiophenyl]propane-1,3-diol IUPAC Name: (1S,2S)-2-amino-1-[4-[(E)-dodec-1-enyl]thiophen-2-yl]propane-1,3-diol Traditional Name: (1S,2S)-2-amino-1-[4-[(E)-dodec-1-enyl]-2-thienyl]propane-1,3-diol Formula: C19H33NO2S MolecularWeight: 339.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CC1=CSC(=C1)C(C(CO)N)O

Isomeric SMILES

CCCCCCCCCC/C=C/C1=CSC(=C1)[C@H]([C@H](CO)N)O

InChI

InChI=1S/C19H33NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-16-13-18(23-15-16)19(22)17(20)14-21/h11-13,15,17,19,21-22H,2-10,14,20H2,1H3/b12-11+/t17-,19-/m0/s1