6-bromanyl-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-bromanyl-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one Openeye Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one CAS Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4H-1,4-benzoxazin-3-one Formula: C17H15BrN2O4S MolecularWeight: 423.281

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Br

InChI

InChI=1S/C17H15BrN2O4S/c18-13-7-14-15(24-10-17(21)19-14)8-16(13)25(22,23)20-6-5-11-3-1-2-4-12(11)9-20/h1-4,7-8H,5-6,9-10H2,(H,19,21)