5-nitro-3-[3-(4-nitrophenyl)benzo[e]indazol-2-ium-2-yl]-2,1-benzothiazole

Systemtic Name: 5-nitro-3-[3-(4-nitrophenyl)benzo[e]indazol-2-ium-2-yl]-2,1-benzothiazole Openeye Name: 5-nitro-3-[3-(4-nitrophenyl)benzo[e]indazol-2-ium-2-yl]-2,1-benzothiazole CAS Name: 5-nitro-3-[3-(4-nitrophenyl)-2-benzo[e]indazol-2-iumyl]-2,1-benzothiazole IUPAC Name: 5-nitro-3-[3-(4-nitrophenyl)benzo[e]indazol-2-ium-2-yl]-2,1-benzothiazole Traditional Name: 5-nitro-3-[3-(4-nitrophenyl)benz[e]indazol-2-ium-2-yl]-2,1-benzothiazole Formula: C24H14N5O4S+ MolecularWeight: 468.46406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C=[N+](N3C4=CC=C(C=C4)[N+](=O)[O-])C5=C6C=C(C=CC6=NS5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C=[N+](N3C4=CC=C(C=C4)[N+](=O)[O-])C5=C6C=C(C=CC6=NS5)[N+](=O)[O-]

InChI

InChI=1S/C24H14N5O4S/c30-28(31)17-8-6-16(7-9-17)27-23-12-5-15-3-1-2-4-19(15)21(23)14-26(27)24-20-13-18(29(32)33)10-11-22(20)25-34-24/h1-14H/q+1