4-methyl-N-[5-nitro-2-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[5-nitro-2-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[5-nitro-2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[5-nitro-2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[5-nitro-2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide Traditional Name: N-[2-(4-keto-3,1-benzoxazin-2-yl)-5-nitro-phenyl]-4-methyl-benzenesulfonamide Formula: C21H15N3O6S MolecularWeight: 437.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H15N3O6S/c1-13-6-9-15(10-7-13)31(28,29)23-19-12-14(24(26)27)8-11-16(19)20-22-18-5-3-2-4-17(18)21(25)30-20/h2-12,23H,1H3