6-bromanyl-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethyl-quinoxaline-2,3-dione

Systemtic Name: 6-bromanyl-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethyl-quinoxaline-2,3-dione Openeye Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethyl-quinoxaline-2,3-dione CAS Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethylquinoxaline-2,3-dione IUPAC Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethylquinoxaline-2,3-dione Traditional Name: 6-bromo-7-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-1,4-dimethyl-quinoxaline-2,3-quinone Formula: C19H18BrN3O4S MolecularWeight: 464.33292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)Br)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)Br)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H18BrN3O4S/c1-21-15-9-14(20)17(10-16(15)22(2)19(25)18(21)24)28(26,27)23-8-7-12-5-3-4-6-13(12)11-23/h3-6,9-10H,7-8,11H2,1-2H3