1-(5-nitro-2-propan-2-yl-phenyl)sulfonylbenzotriazole

Systemtic Name: 1-(5-nitro-2-propan-2-yl-phenyl)sulfonylbenzotriazole Openeye Name: 1-(2-isopropyl-5-nitro-phenyl)sulfonylbenzotriazole CAS Name: 1-(5-nitro-2-propan-2-ylphenyl)sulfonylbenzotriazole IUPAC Name: 1-(5-nitro-2-propan-2-ylphenyl)sulfonylbenzotriazole Traditional Name: 1-(2-isopropyl-5-nitro-phenyl)sulfonylbenzotriazole Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H14N4O4S/c1-10(2)12-8-7-11(19(20)21)9-15(12)24(22,23)18-14-6-4-3-5-13(14)16-17-18/h3-10H,1-2H3