2-(2-azanylethyldisulfanyl)ethanamine; bis(4-nitrophenyl)carbamic acid

Systemtic Name: 2-(2-azanylethyldisulfanyl)ethanamine; bis(4-nitrophenyl)carbamic acid Openeye Name: 2-(2-aminoethyldisulfanyl)ethanamine; bis(4-nitrophenyl)carbamic acid CAS Name: 2-(2-aminoethyldisulfanyl)ethanamine; bis(4-nitrophenyl)carbamic acid IUPAC Name: 2-(2-aminoethyldisulfanyl)ethanamine; bis(4-nitrophenyl)carbamic acid Traditional Name: 2-(2-aminoethyldisulfanyl)ethylamine; bis(4-nitrophenyl)carbamic acid Formula: C17H21N5O6S2 MolecularWeight: 455.50854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-].C(CSSCCN)N

Isomeric SMILES

C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-].C(CSSCCN)N

InChI

InChI=1S/C13H9N3O6.C4H12N2S2/c17-13(18)14(9-1-5-11(6-2-9)15(19)20)10-3-7-12(8-4-10)16(21)22;5-1-3-7-8-4-2-6/h1-8H,(H,17,18);1-6H2