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

Systemtic Name: N-[2-[(4-methylphenyl)amino]phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-[2-(4-methylanilino)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[2-(4-methylanilino)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-[2-(4-methylanilino)phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[2-(p-toluidino)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H19N3O4S/c1-14-6-8-15(9-7-14)22-17-4-2-3-5-18(17)24-29(26,27)16-10-11-20-19(12-16)23-21(25)13-28-20/h2-12,22,24H,13H2,1H3,(H,23,25)