6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-oxidanylidene-propyl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione

Systemtic Name: 6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-oxidanylidene-propyl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione Openeye Name: 6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-oxo-propyl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione CAS Name: 6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-oxopropyl]sulfonyl-1,4-dimethylquinoxaline-2,3-dione IUPAC Name: 6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-oxopropyl]sulfonyl-1,4-dimethylquinoxaline-2,3-dione Traditional Name: 6-[3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-3-keto-propyl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-quinone Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)N3CCOC4=CC=CC=C4C3)N(C(=O)C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)N3CCOC4=CC=CC=C4C3)N(C(=O)C1=O)C

InChI

InChI=1S/C22H23N3O6S/c1-23-17-8-7-16(13-18(17)24(2)22(28)21(23)27)32(29,30)12-9-20(26)25-10-11-31-19-6-4-3-5-15(19)14-25/h3-8,13H,9-12,14H2,1-2H3