decyl-[3-(4-nitro-2-sulfanyl-phenyl)propyl]azanium chloride

Systemtic Name: decyl-[3-(4-nitro-2-sulfanyl-phenyl)propyl]azanium chloride Openeye Name: decyl-[3-(4-nitro-2-sulfanyl-phenyl)propyl]ammonium chloride CAS Name: decyl-[3-(2-mercapto-4-nitrophenyl)propyl]ammonium chloride IUPAC Name: decyl-[3-(4-nitro-2-sulfanylphenyl)propyl]azanium chloride Traditional Name: decyl-[3-(2-mercapto-4-nitro-phenyl)propyl]ammonium chloride Formula: C19H33ClN2O2S MolecularWeight: 388.99552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[NH2+]CCCC1=C(C=C(C=C1)[N+](=O)[O-])S.[Cl-]

Isomeric SMILES

CCCCCCCCCC[NH2+]CCCC1=C(C=C(C=C1)[N+](=O)[O-])S.[Cl-]

InChI

InChI=1S/C19H32N2O2S.ClH/c1-2-3-4-5-6-7-8-9-14-20-15-10-11-17-12-13-18(21(22)23)16-19(17)24;/h12-13,16,20,24H,2-11,14-15H2,1H3;1H