6-chloranyl-N-(2-dimethylaminoethyl)-3-oxidanylidene-N-(phenylmethyl)-4H-1,4-benzoxazine-7-sulfonamide

Systemtic Name: 6-chloranyl-N-(2-dimethylaminoethyl)-3-oxidanylidene-N-(phenylmethyl)-4H-1,4-benzoxazine-7-sulfonamide Openeye Name: N-benzyl-6-chloro-N-(2-dimethylaminoethyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide CAS Name: 6-chloro-N-(2-dimethylaminoethyl)-3-oxo-N-(phenylmethyl)-4H-1,4-benzoxazine-7-sulfonamide IUPAC Name: N-benzyl-6-chloro-N-(2-dimethylaminoethyl)-3-oxo-4H-1,4-benzoxazine-7-sulfonamide Traditional Name: N-benzyl-6-chloro-N-(2-dimethylaminoethyl)-3-keto-4H-1,4-benzoxazine-7-sulfonamide Formula: C19H22ClN3O4S MolecularWeight: 423.91368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CN(C)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C19H22ClN3O4S/c1-22(2)8-9-23(12-14-6-4-3-5-7-14)28(25,26)18-11-17-16(10-15(18)20)21-19(24)13-27-17/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,21,24)