2-[azanyl-(8-bromanyl-3-cyano-10-oxidanylidene-phenoxazin-10-ium-2-yl)amino]-8-ethyl-10-oxidanylidene-phenoxazin-10-ium-3-carbonitrile

Systemtic Name: 2-[azanyl-(8-bromanyl-3-cyano-10-oxidanylidene-phenoxazin-10-ium-2-yl)amino]-8-ethyl-10-oxidanylidene-phenoxazin-10-ium-3-carbonitrile Openeye Name: 2-[amino-(8-bromo-3-cyano-10-oxo-phenoxazin-10-ium-2-yl)amino]-8-ethyl-10-oxo-phenoxazin-10-ium-3-carbonitrile CAS Name: 2-[amino-(8-bromo-3-cyano-10-oxo-2-phenoxazin-10-iumyl)amino]-8-ethyl-10-oxo-3-phenoxazin-10-iumcarbonitrile IUPAC Name: 2-[amino-(8-bromo-3-cyano-10-oxophenoxazin-10-ium-2-yl)amino]-8-ethyl-10-oxophenoxazin-10-ium-3-carbonitrile Traditional Name: 2-[amino-(8-bromo-3-cyano-10-keto-phenoxazin-10-ium-2-yl)amino]-8-ethyl-10-keto-phenoxazin-10-ium-3-carbonitrile Formula: C28H17BrN6O4+2 MolecularWeight: 581.37638

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC3=C([N+]2=O)C=C(C(=C3)C#N)N(C4=CC5=C(C=C4C#N)OC6=C([N+]5=O)C=C(C=C6)Br)N

Isomeric SMILES

CCC1=CC2=C(C=C1)OC3=C([N+]2=O)C=C(C(=C3)C#N)N(C4=CC5=C(C=C4C#N)OC6=C([N+]5=O)C=C(C=C6)Br)N

InChI

InChI=1S/C28H17BrN6O4/c1-2-15-3-5-25-21(7-15)34(36)23-11-19(16(13-30)8-27(23)38-25)33(32)20-12-24-28(9-17(20)14-31)39-26-6-4-18(29)10-22(26)35(24)37/h3-12H,2,32H2,1H3/q+2