N-tert-butyl-4-[[3-(hydroxymethyl)phenyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[[3-(hydroxymethyl)phenyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[3-(hydroxymethyl)anilino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[3-(hydroxymethyl)anilino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[3-(hydroxymethyl)anilino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(3-methylolanilino)-3-nitro-benzenesulfonamide Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O5S/c1-17(2,3)19-26(24,25)14-7-8-15(16(10-14)20(22)23)18-13-6-4-5-12(9-13)11-21/h4-10,18-19,21H,11H2,1-3H3