6-bromanyl-1-methyl-4-(phenylsulfonyl)-2,3-dihydropyrazolo[1,5-b]isoquinolin-9-one

Systemtic Name: 6-bromanyl-1-methyl-4-(phenylsulfonyl)-2,3-dihydropyrazolo[1,5-b]isoquinolin-9-one Openeye Name: 4-(benzenesulfonyl)-6-bromo-1-methyl-2,3-dihydropyrazolo[1,5-b]isoquinolin-9-one CAS Name: 4-(benzenesulfonyl)-6-bromo-1-methyl-2,3-dihydropyrazolo[1,5-b]isoquinolin-9-one IUPAC Name: 4-(benzenesulfonyl)-6-bromo-1-methyl-2,3-dihydropyrazolo[1,5-b]isoquinolin-9-one Traditional Name: 4-besyl-6-bromo-1-methyl-2,3-dihydropyrazol[1,5-b]isoquinolin-9-one Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C3=C(C=CC(=C3)Br)C(=O)N21)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCC2=C(C3=C(C=CC(=C3)Br)C(=O)N21)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H15BrN2O3S/c1-20-10-9-16-17(25(23,24)13-5-3-2-4-6-13)15-11-12(19)7-8-14(15)18(22)21(16)20/h2-8,11H,9-10H2,1H3