9-(2-azanylethyl)-1,2,3,4,5-benzopentathiepine-6,7-diol

Systemtic Name: 9-(2-azanylethyl)-1,2,3,4,5-benzopentathiepine-6,7-diol Openeye Name: 9-(2-aminoethyl)-1,2,3,4,5-benzopentathiepine-6,7-diol CAS Name: 9-(2-aminoethyl)-1,2,3,4,5-benzopentathiepin-6,7-diol IUPAC Name: 9-(2-aminoethyl)-1,2,3,4,5-benzopentathiepine-6,7-diol Traditional Name: 9-(2-aminoethyl)-1,2,3,4,5-benzopentathiepin-6,7-diol Formula: C8H9NO2S5 MolecularWeight: 311.48756

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(C(=C1O)O)SSSSS2)CCN

Isomeric SMILES

C1=C(C2=C(C(=C1O)O)SSSSS2)CCN

InChI

InChI=1S/C8H9NO2S5/c9-2-1-4-3-5(10)6(11)8-7(4)12-14-16-15-13-8/h3,10-11H,1-2,9H2