N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-chloranyl-N-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-chloranyl-N-methyl-3-oxidanylidene-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-6-chloro-N-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-6-chloro-N-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-6-chloro-N-methyl-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-6-chloro-3-keto-N-methyl-4H-1,4-benzoxazine-7-sulfonamide Formula: C17H22ClN3O5S MolecularWeight: 415.89168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCCCC1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CN(CC(=O)N1CCCCCC1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C17H22ClN3O5S/c1-20(10-17(23)21-6-4-2-3-5-7-21)27(24,25)15-9-14-13(8-12(15)18)19-16(22)11-26-14/h8-9H,2-7,10-11H2,1H3,(H,19,22)