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

Systemtic Name: N-tert-butyl-4-[(3-chloranyl-4-methoxy-phenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(3-chloro-4-methoxy-anilino)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(3-chloro-4-methoxyanilino)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(3-chloro-4-methoxyanilino)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(3-chloro-4-methoxy-anilino)-3-nitro-benzenesulfonamide Formula: C17H20ClN3O5S MolecularWeight: 413.8758

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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)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN3O5S/c1-17(2,3)20-27(24,25)12-6-7-14(15(10-12)21(22)23)19-11-5-8-16(26-4)13(18)9-11/h5-10,19-20H,1-4H3