N-tert-butyl-4-(4-cyano-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(4-cyano-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(4-cyano-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(4-cyano-2-methoxyphenoxy)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(4-cyano-2-methoxyphenoxy)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(4-cyano-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C#N)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C#N)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6S/c1-18(2,3)20-28(24,25)13-6-8-15(14(10-13)21(22)23)27-16-7-5-12(11-19)9-17(16)26-4/h5-10,20H,1-4H3