ethenamine; N-ethylethanamine; methyl [(E)-nonadec-10-enyl] sulfate

Systemtic Name: ethenamine; N-ethylethanamine; methyl [(E)-nonadec-10-enyl] sulfate Openeye Name: ethenamine; N-ethylethanamine; methyl [(E)-nonadec-10-enyl] sulfate CAS Name: ethenamine; N-ethylethanamine; sulfuric acid methyl [(E)-nonadec-10-enyl] ester IUPAC Name: ethenamine; N-ethylethanamine; methyl [(E)-nonadec-10-enyl] sulfate Traditional Name: diethylamine; sulfuric acid methyl [(E)-nonadec-10-enyl] ester; vinylamine Formula: C26H56N2O4S MolecularWeight: 492.79884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCOS(=O)(=O)OC.CCNCC.C=CN

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCOS(=O)(=O)OC.CCNCC.C=CN

InChI

InChI=1S/C20H40O4S.C4H11N.C2H5N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-25(21,22)23-2;1-3-5-4-2;1-2-3/h10-11H,3-9,12-20H2,1-2H3;5H,3-4H2,1-2H3;2H,1,3H2/b11-10+;;