N-tert-butyl-4-[(3-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(3-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[(3-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[(3-chlorophenyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[(3-chlorophenyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(3-chlorobenzyl)amino]-3-nitro-benzenesulfonamide Formula: C17H20ClN3O4S MolecularWeight: 397.8764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H20ClN3O4S/c1-17(2,3)20-26(24,25)14-7-8-15(16(10-14)21(22)23)19-11-12-5-4-6-13(18)9-12/h4-10,19-20H,11H2,1-3H3