N-[2-(1-adamantyloxy)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1-adamantyloxy)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(1-adamantyloxy)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(1-adamantyloxy)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-adamantyloxy)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(1-adamantyloxy)ethyl]-3-nitro-benzenesulfonamide Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OCCNS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OCCNS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H24N2O5S/c21-20(22)16-2-1-3-17(9-16)26(23,24)19-4-5-25-18-10-13-6-14(11-18)8-15(7-13)12-18/h1-3,9,13-15,19H,4-8,10-12H2