(7-azanylphenothiazin-3-ylidene)azanium ethanoate

Systemtic Name: (7-azanylphenothiazin-3-ylidene)azanium ethanoate Openeye Name: (7-aminophenothiazin-3-ylidene)ammonium acetate CAS Name: (7-amino-3-phenothiazinylidene)ammonium acetate IUPAC Name: (7-aminophenothiazin-3-ylidene)azanium acetate Traditional Name: (7-aminophenothiazin-3-ylidene)ammonium acetate Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC2=C(C=C1N)SC3=CC(=[NH2+])C=CC3=N2

Isomeric SMILES

CC(=O)[O-].C1=CC2=C(C=C1N)SC3=CC(=[NH2+])C=CC3=N2

InChI

InChI=1S/C12H9N3S.C2H4O2/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;1-2(3)4/h1-6,13H,14H2;1H3,(H,3,4)