[2-(benzotriazol-2-yl)-4-methyl-phenyl] 5-nitrofuran-2-carboxylate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 5-nitrofuran-2-carboxylate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C18H12N4O5 MolecularWeight: 364.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(O2)[N+](=O)[O-])N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(O2)[N+](=O)[O-])N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C18H12N4O5/c1-11-6-7-15(27-18(23)16-8-9-17(26-16)22(24)25)14(10-11)21-19-12-4-2-3-5-13(12)20-21/h2-10H,1H3