6-chloranyl-N-[[4-(diethylamino)phenyl]methyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-[[4-(diethylamino)phenyl]methyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-[[4-(diethylamino)phenyl]methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-[[4-(diethylamino)phenyl]methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-[[4-(diethylamino)phenyl]methyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-N-[4-(diethylamino)benzyl]-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C19H22ClN3O4S MolecularWeight: 423.91368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN3O4S/c1-3-23(4-2)14-7-5-13(6-8-14)11-21-28(25,26)18-10-17-16(9-15(18)20)22-19(24)12-27-17/h5-10,21H,3-4,11-12H2,1-2H3,(H,22,24)