9-(2-azanylethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol

Systemtic Name: 9-(2-azanylethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol Openeye Name: 9-(2-aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol CAS Name: 9-(2-aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol IUPAC Name: 9-(2-aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol Traditional Name: 9-(2-aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol Formula: C9H11NO2S5 MolecularWeight: 325.51414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=C1SSSSS2)CCN)O

Isomeric SMILES

COC1=C(C=C(C2=C1SSSSS2)CCN)O

InChI

InChI=1S/C9H11NO2S5/c1-12-7-6(11)4-5(2-3-10)8-9(7)14-16-17-15-13-8/h4,11H,2-3,10H2,1H3