N-[1-(1-adamantyl)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-nitro-benzenesulfonamide Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H24N2O4S/c1-12(18-9-13-5-14(10-18)7-15(6-13)11-18)19-25(23,24)17-4-2-3-16(8-17)20(21)22/h2-4,8,12-15,19H,5-7,9-11H2,1H3