1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)benzotriazole

Systemtic Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)benzotriazole Openeye Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)benzotriazole CAS Name: 1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]benzotriazole IUPAC Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)benzotriazole Traditional Name: 1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)benzotriazole Formula: C16H15N5O4S MolecularWeight: 373.3864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3C4=CC=CC=C4N=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3C4=CC=CC=C4N=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O4S/c22-21(23)16-11-12(26(24,25)19-9-3-4-10-19)7-8-15(16)20-14-6-2-1-5-13(14)17-18-20/h1-2,5-8,11H,3-4,9-10H2