9H-fluoren-9-yl 4-methylsulfanyl-3-nitro-benzoate

Systemtic Name: 9H-fluoren-9-yl 4-methylsulfanyl-3-nitro-benzoate Openeye Name: 9H-fluoren-9-yl 4-methylsulfanyl-3-nitro-benzoate CAS Name: 4-(methylthio)-3-nitrobenzoic acid 9H-fluoren-9-yl ester IUPAC Name: 9H-fluoren-9-yl 4-methylsulfanyl-3-nitrobenzoate Traditional Name: 4-(methylthio)-3-nitro-benzoic acid 9H-fluoren-9-yl ester Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)OC2C3=CC=CC=C3C4=CC=CC=C24)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)OC2C3=CC=CC=C3C4=CC=CC=C24)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO4S/c1-27-19-11-10-13(12-18(19)22(24)25)21(23)26-20-16-8-4-2-6-14(16)15-7-3-5-9-17(15)20/h2-12,20H,1H3