9H-fluoren-9-ylmethyl 3-nitro-1,2,4-triazole-1-carboxylate

Systemtic Name: 9H-fluoren-9-ylmethyl 3-nitro-1,2,4-triazole-1-carboxylate Openeye Name: 9H-fluoren-9-ylmethyl 3-nitro-1,2,4-triazole-1-carboxylate CAS Name: 3-nitro-1,2,4-triazole-1-carboxylic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 3-nitro-1,2,4-triazole-1-carboxylate Traditional Name: 3-nitro-1,2,4-triazole-1-carboxylic acid 9H-fluoren-9-ylmethyl ester Formula: C17H12N4O4 MolecularWeight: 336.30158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N4C=NC(=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N4C=NC(=N4)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O4/c22-17(20-10-18-16(19-20)21(23)24)25-9-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,10,15H,9H2