(2-methylphenyl)-(6-nitro-4-oxidanylidene-1,3-benzodithiin-2-ylidene)azanium

Systemtic Name: (2-methylphenyl)-(6-nitro-4-oxidanylidene-1,3-benzodithiin-2-ylidene)azanium Openeye Name: (6-nitro-4-oxo-1,3-benzodithiin-2-ylidene)-(o-tolyl)ammonium CAS Name: (2-methylphenyl)-(6-nitro-4-oxo-1,3-benzodithiin-2-ylidene)ammonium IUPAC Name: (2-methylphenyl)-(6-nitro-4-oxo-1,3-benzodithiin-2-ylidene)azanium Traditional Name: (4-keto-6-nitro-1,3-benzodithiin-2-ylidene)-(o-tolyl)ammonium Formula: C15H11N2O3S2+ MolecularWeight: 331.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[NH+]=C2SC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)S2

Isomeric SMILES

CC1=CC=CC=C1[NH+]=C2SC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)S2

InChI

InChI=1S/C15H10N2O3S2/c1-9-4-2-3-5-12(9)16-15-21-13-7-6-10(17(19)20)8-11(13)14(18)22-15/h2-8H,1H3/p+1