4-(benzotriazol-1-yl)-N-tert-butyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(benzotriazol-1-yl)-N-tert-butyl-3-nitro-benzenesulfonamide Openeye Name: 4-(benzotriazol-1-yl)-N-tert-butyl-3-nitro-benzenesulfonamide CAS Name: 4-(1-benzotriazolyl)-N-tert-butyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(benzotriazol-1-yl)-N-tert-butyl-3-nitrobenzenesulfonamide Traditional Name: 4-(benzotriazol-1-yl)-N-tert-butyl-3-nitro-benzenesulfonamide Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O4S/c1-16(2,3)18-26(24,25)11-8-9-14(15(10-11)21(22)23)20-13-7-5-4-6-12(13)17-19-20/h4-10,18H,1-3H3