6-chloranyl-N-(3,3-dimethyl-1-phenyl-butyl)-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-(3,3-dimethyl-1-phenyl-butyl)-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-(3,3-dimethyl-1-phenyl-butyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-(3,3-dimethyl-1-phenylbutyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-(3,3-dimethyl-1-phenylbutyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-N-(3,3-dimethyl-1-phenyl-butyl)-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C1=CC=CC=C1)NS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CC(C)(C)CC(C1=CC=CC=C1)NS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C20H23ClN2O4S/c1-20(2,3)11-16(13-7-5-4-6-8-13)23-28(25,26)18-10-17-15(9-14(18)21)22-19(24)12-27-17/h4-10,16,23H,11-12H2,1-3H3,(H,22,24)