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

Systemtic Name: 6-chloranyl-N-[3-[methyl(phenyl)amino]propyl]-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: 6-chloro-N-[3-(N-methylanilino)propyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-[3-(N-methylanilino)propyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: 6-chloro-N-[3-(N-methylanilino)propyl]-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: 6-chloro-3-keto-N-[3-(N-methylanilino)propyl]-4H-1,4-benzoxazine-7-sulfonamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O4S/c1-22(13-6-3-2-4-7-13)9-5-8-20-27(24,25)17-11-16-15(10-14(17)19)21-18(23)12-26-16/h2-4,6-7,10-11,20H,5,8-9,12H2,1H3,(H,21,23)