7-bromanyl-11-(2-methylpropyl)-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide

Systemtic Name: 7-bromanyl-11-(2-methylpropyl)-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide Openeye Name: 7-bromo-11-isobutyl-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide CAS Name: 7-bromo-11-(2-methylpropyl)-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide IUPAC Name: 7-bromo-11-(2-methylpropyl)-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide Traditional Name: 7-bromo-11-isobutyl-12H-benzo[d][6,1,2]benzoxathiazocine 10,10-dioxide Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC2=CC=CC=C2OC3=C(S1(=O)=O)C=CC(=C3)Br

Isomeric SMILES

CC(C)CN1CC2=CC=CC=C2OC3=C(S1(=O)=O)C=CC(=C3)Br

InChI

InChI=1S/C17H18BrNO3S/c1-12(2)10-19-11-13-5-3-4-6-15(13)22-16-9-14(18)7-8-17(16)23(19,20)21/h3-9,12H,10-11H2,1-2H3