ethane-1,2-diamine; methyl hydrogen sulfate; (E)-2-methylicos-11-ene-1,2-diamine

Systemtic Name: ethane-1,2-diamine; methyl hydrogen sulfate; (E)-2-methylicos-11-ene-1,2-diamine Openeye Name: ethane-1,2-diamine; methyl hydrogen sulfate; (E)-2-methylicos-11-ene-1,2-diamine CAS Name: ethane-1,2-diamine; (E)-2-methyl-11-eicosene-1,2-diamine; sulfuric acid methyl ester IUPAC Name: ethane-1,2-diamine; methyl hydrogen sulfate; (E)-2-methylicos-11-ene-1,2-diamine Traditional Name: 2-aminoethylamine; [(E)-2-amino-2-methyl-eicos-11-enyl]amine; sulfuric acid methyl ester Formula: C24H56N4O4S MolecularWeight: 496.79084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(C)(CN)N.COS(=O)(=O)O.C(CN)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC(C)(CN)N.COS(=O)(=O)O.C(CN)N

InChI

InChI=1S/C21H44N2.C2H8N2.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(2,23)20-22;3-1-2-4;1-5-6(2,3)4/h10-11H,3-9,12-20,22-23H2,1-2H3;1-4H2;1H3,(H,2,3,4)/b11-10+;;