N-[2-[(4-nitrophenyl)amino]ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-[2-(4-nitroanilino)ethyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[2-(4-nitroanilino)ethyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-[2-(4-nitroanilino)ethyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[2-(4-nitroanilino)ethyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C16H16N4O6S MolecularWeight: 392.38644

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O6S/c21-16-10-26-15-6-5-13(9-14(15)19-16)27(24,25)18-8-7-17-11-1-3-12(4-2-11)20(22)23/h1-6,9,17-18H,7-8,10H2,(H,19,21)