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

Systemtic Name: 3-chloranyl-N-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: 3-chloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: 3-chloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[3-keto-4-(3-methoxypropyl)-2-methyl-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O5S/c1-14-20(24)23(9-4-10-27-2)13-15-11-17(7-8-19(15)28-14)22-29(25,26)18-6-3-5-16(21)12-18/h3,5-8,11-12,14,22H,4,9-10,13H2,1-2H3