N-(2-adamantyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-adamantyl)-3-nitro-benzenesulfonamide Openeye Name: N-(2-adamantyl)-3-nitro-benzenesulfonamide CAS Name: N-(2-adamantyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-adamantyl)-3-nitrobenzenesulfonamide Traditional Name: N-(2-adamantyl)-3-nitro-benzenesulfonamide Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O4S/c19-18(20)14-2-1-3-15(9-14)23(21,22)17-16-12-5-10-4-11(7-12)8-13(16)6-10/h1-3,9-13,16-17H,4-8H2