N-(2-bromophenyl)-4-ethanoyl-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-(2-bromophenyl)-4-ethanoyl-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Openeye Name: 4-acetyl-N-(2-bromophenyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide CAS Name: 4-acetyl-N-(2-bromophenyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide IUPAC Name: 4-acetyl-N-(2-bromophenyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Traditional Name: 4-acetyl-N-(2-bromophenyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1Br)S(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C

Isomeric SMILES

CCCN(C1=CC=CC=C1Br)S(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C

InChI

InChI=1S/C19H21BrN2O4S/c1-3-10-22(17-7-5-4-6-16(17)20)27(24,25)15-8-9-19-18(13-15)21(14(2)23)11-12-26-19/h4-9,13H,3,10-12H2,1-2H3