6-chloranyl-N-(3-methyl-2-phenyl-butyl)-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-(3-methyl-2-phenyl-butyl)-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-(3-methyl-2-phenyl-butyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-(3-methyl-2-phenylbutyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-(3-methyl-2-phenylbutyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-3-keto-N-(3-methyl-2-phenyl-butyl)-4H-1,4-benzoxazine-7-sulfonamide Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNS(=O)(=O)C1=C(C=C2C(=C1)OCC(=O)N2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CNS(=O)(=O)C1=C(C=C2C(=C1)OCC(=O)N2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H21ClN2O4S/c1-12(2)14(13-6-4-3-5-7-13)10-21-27(24,25)18-9-17-16(8-15(18)20)22-19(23)11-26-17/h3-9,12,14,21H,10-11H2,1-2H3,(H,22,23)