2,7-dinitro-9-(5-phenyl-1,2-dithiol-1-ium-3-yl)-9H-fluorene-4-carboxylic acid

Systemtic Name: 2,7-dinitro-9-(5-phenyl-1,2-dithiol-1-ium-3-yl)-9H-fluorene-4-carboxylic acid Openeye Name: 2,7-dinitro-9-(5-phenyldithiol-1-ium-3-yl)-9H-fluorene-4-carboxylic acid CAS Name: 2,7-dinitro-9-(5-phenyl-3-dithiol-1-iumyl)-9H-fluorene-4-carboxylic acid IUPAC Name: 2,7-dinitro-9-(5-phenyldithiol-1-ium-3-yl)-9H-fluorene-4-carboxylic acid Traditional Name: 2,7-dinitro-9-(5-phenyldithiol-1-ium-3-yl)-9H-fluorene-4-carboxylic acid Formula: C23H13N2O6S2+ MolecularWeight: 477.48912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[S+]SC(=C2)C3C4=C(C=CC(=C4)[N+](=O)[O-])C5=C3C=C(C=C5C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=[S+]SC(=C2)C3C4=C(C=CC(=C4)[N+](=O)[O-])C5=C3C=C(C=C5C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C23H12N2O6S2/c26-23(27)18-10-14(25(30)31)9-17-21(18)15-7-6-13(24(28)29)8-16(15)22(17)20-11-19(32-33-20)12-4-2-1-3-5-12/h1-11,22H/p+1