4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbonyl-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide

Systemtic Name: 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbonyl-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Openeye Name: 4-(3,5-dichloro-4-hydroxy-benzoyl)-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide CAS Name: 4-[(3,5-dichloro-4-hydroxyphenyl)-oxomethyl]-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide IUPAC Name: 4-(3,5-dichloro-4-hydroxybenzoyl)-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Traditional Name: 4-(3,5-dichloro-4-hydroxy-benzoyl)-N,N-diethyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Formula: C19H20Cl2N2O5S MolecularWeight: 459.3435

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OCCN2C(=O)C3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OCCN2C(=O)C3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C19H20Cl2N2O5S/c1-3-22(4-2)29(26,27)13-5-6-17-16(11-13)23(7-8-28-17)19(25)12-9-14(20)18(24)15(21)10-12/h5-6,9-11,24H,3-4,7-8H2,1-2H3