N-(4-bromanyl-3-methyl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Openeye Name: 4-acetyl-N-(4-bromo-3-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-6-sulfonamide CAS Name: 4-acetyl-N-(4-bromo-3-methylphenyl)-2,3-dihydro-1,4-benzoxazine-6-sulfonamide IUPAC Name: 4-acetyl-N-(4-bromo-3-methylphenyl)-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Traditional Name: 4-acetyl-N-(4-bromo-3-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C)Br

InChI

InChI=1S/C17H17BrN2O4S/c1-11-9-13(3-5-15(11)18)19-25(22,23)14-4-6-17-16(10-14)20(12(2)21)7-8-24-17/h3-6,9-10,19H,7-8H2,1-2H3