2-azanyl-6-(4-nitrophenoxy)hexane-1-thiol hydrochloride

Systemtic Name: 2-azanyl-6-(4-nitrophenoxy)hexane-1-thiol hydrochloride Openeye Name: 2-amino-6-(4-nitrophenoxy)hexane-1-thiol hydrochloride CAS Name: 2-amino-6-(4-nitrophenoxy)-1-hexanethiol hydrochloride IUPAC Name: 2-amino-6-(4-nitrophenoxy)hexane-1-thiol hydrochloride Traditional Name: 2-amino-6-(4-nitrophenoxy)hexane-1-thiol hydrochloride Formula: C12H19ClN2O3S MolecularWeight: 306.80886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCCCCC(CS)N.Cl

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCCCCC(CS)N.Cl

InChI

InChI=1S/C12H18N2O3S.ClH/c13-10(9-18)3-1-2-8-17-12-6-4-11(5-7-12)14(15)16;/h4-7,10,18H,1-3,8-9,13H2;1H