N'-(2-azanylethyl)ethane-1,2-diamine; diethyl sulfate; (E)-octadec-9-enoic acid

Systemtic Name: N'-(2-azanylethyl)ethane-1,2-diamine; diethyl sulfate; (E)-octadec-9-enoic acid Openeye Name: N'-(2-aminoethyl)ethane-1,2-diamine; diethyl sulfate; (E)-octadec-9-enoic acid CAS Name: N'-(2-aminoethyl)ethane-1,2-diamine; (E)-9-octadecenoic acid; sulfuric acid diethyl ester IUPAC Name: N'-(2-aminoethyl)ethane-1,2-diamine; diethyl sulfate; (E)-octadec-9-enoic acid Traditional Name: bis(2-aminoethyl)amine; elaidic acid; sulfuric acid diethyl ester Formula: C26H57N3O6S MolecularWeight: 539.81228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)O.CCOS(=O)(=O)OCC.C(CNCCN)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)O.CCOS(=O)(=O)OCC.C(CNCCN)N

InChI

InChI=1S/C18H34O2.C4H13N3.C4H10O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;5-1-3-7-4-2-6;1-3-7-9(5,6)8-4-2/h9-10H,2-8,11-17H2,1H3,(H,19,20);7H,1-6H2;3-4H2,1-2H3/b10-9+;;