N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[2-(1-adamantyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H26N2O4S/c1-13-2-3-17(21(22)23)9-18(13)26(24,25)20-5-4-19-10-14-6-15(11-19)8-16(7-14)12-19/h2-3,9,14-16,20H,4-8,10-12H2,1H3