N-tert-butyl-4-[(3,4-dimethoxyphenyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(3,4-dimethoxyphenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(3,4-dimethoxyanilino)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(3,4-dimethoxyanilino)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(3,4-dimethoxyanilino)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(3,4-dimethoxyanilino)-3-nitro-benzenesulfonamide Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O6S/c1-18(2,3)20-28(24,25)13-7-8-14(15(11-13)21(22)23)19-12-6-9-16(26-4)17(10-12)27-5/h6-11,19-20H,1-5H3