3-fluoranyl-N-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-4-methyl-benzenesulfonamide

Systemtic Name: 3-fluoranyl-N-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-4-methyl-benzenesulfonamide Openeye Name: 3-fluoro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-methyl-benzenesulfonamide CAS Name: 3-fluoro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-methylbenzenesulfonamide IUPAC Name: 3-fluoro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-methylbenzenesulfonamide Traditional Name: 3-fluoro-N-[3-keto-4-(3-methoxypropyl)-2-methyl-5H-1,4-benzoxazepin-7-yl]-4-methyl-benzenesulfonamide Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)CCCOC

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)CCCOC

InChI

InChI=1S/C21H25FN2O5S/c1-14-5-7-18(12-19(14)22)30(26,27)23-17-6-8-20-16(11-17)13-24(9-4-10-28-3)21(25)15(2)29-20/h5-8,11-12,15,23H,4,9-10,13H2,1-3H3