1-chloranylhexadecane; (E)-4-(dimethylamino)-2-methyl-pent-2-enoate

Systemtic Name: 1-chloranylhexadecane; (E)-4-(dimethylamino)-2-methyl-pent-2-enoate Openeye Name: 1-chlorohexadecane; (E)-4-(dimethylamino)-2-methyl-pent-2-enoate CAS Name: 1-chlorohexadecane; (E)-4-(dimethylamino)-2-methyl-2-pentenoate IUPAC Name: 1-chlorohexadecane; (E)-4-(dimethylamino)-2-methylpent-2-enoate Traditional Name: 1-chlorohexadecane; (E)-4-(dimethylamino)-2-methyl-pent-2-enoate Formula: C24H47ClNO2- MolecularWeight: 417.08848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCl.CC(C=C(C)C(=O)[O-])N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCl.CC(/C=C(\C)/C(=O)[O-])N(C)C

InChI

InChI=1S/C16H33Cl.C8H15NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;1-6(8(10)11)5-7(2)9(3)4/h2-16H2,1H3;5,7H,1-4H3,(H,10,11)/p-1/b;6-5+