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bis(prop-2-enyl)azanium; dodecane-1-sulfonic acid

bis(prop-2-enyl)azanium; dodecane-1-sulfonic acid

Systemtic Name:bis(prop-2-enyl)azanium; dodecane-1-sulfonic acid
Openeye Name:diallylammonium; dodecane-1-sulfonic acid
CAS Name:bis(prop-2-enyl)ammonium; 1-dodecanesulfonic acid
IUPAC Name:bis(prop-2-enyl)azanium; dodecane-1-sulfonic acid
Traditional Name:diallylammonium; dodecane-1-sulfonic acid
Formula: C18H38NO3S+
MolecularWeight: 348.56422
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)O.C=CC[NH2+]CC=C


Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)O.C=CC[NH2+]CC=C


InChI

InChI=1S/C12H26O3S.C6H11N/c1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15;1-3-5-7-6-4-2/h2-12H2,1H3,(H,13,14,15);3-4,7H,1-2,5-6H2/p+1


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