8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 8-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C(=O)N2

InChI

InChI=1S/C23H20N2O4S/c1-15-6-8-22-20(12-15)24-23(26)19-13-18(7-9-21(19)29-22)30(27,28)25-11-10-16-4-2-3-5-17(16)14-25/h2-9,12-13H,10-11,14H2,1H3,(H,24,26)