[(E)-octadec-9-enyl] 1-azanylpropane-2-sulfonate

Systemtic Name: [(E)-octadec-9-enyl] 1-azanylpropane-2-sulfonate Openeye Name: [(E)-octadec-9-enyl] 1-aminopropane-2-sulfonate CAS Name: 1-amino-2-propanesulfonic acid IUPAC Name: [(E)-octadec-9-enyl] 1-aminopropane-2-sulfonate Traditional Name: 1-aminopropane-2-sulfonic acid [(E)-octadec-9-enyl] ester Formula: C21H43NO3S MolecularWeight: 389.63602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOS(=O)(=O)C(C)CN

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOS(=O)(=O)C(C)CN

InChI

InChI=1S/C21H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-26(23,24)21(2)20-22/h10-11,21H,3-9,12-20,22H2,1-2H3/b11-10+