N-[1-(4-tert-butylphenyl)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-3-nitro-benzenesulfonamide Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O4S/c1-13(14-8-10-15(11-9-14)18(2,3)4)19-25(23,24)17-7-5-6-16(12-17)20(21)22/h5-13,19H,1-4H3