N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]naphthalene-1-sulfonamide

Systemtic Name: N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]naphthalene-1-sulfonamide Openeye Name: N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]naphthalene-1-sulfonamide CAS Name: N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1-naphthalenesulfonamide IUPAC Name: N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]naphthalene-1-sulfonamide Traditional Name: N-[9-(trifluoromethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]naphthalene-1-sulfonamide Formula: C20H17F3N2O3S MolecularWeight: 422.42079

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2CN1)NS(=O)(=O)C3=CC=CC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1COC2=C(C=C(C=C2CN1)NS(=O)(=O)C3=CC=CC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C20H17F3N2O3S/c21-20(22,23)17-11-15(10-14-12-24-8-9-28-19(14)17)25-29(26,27)18-7-3-5-13-4-1-2-6-16(13)18/h1-7,10-11,24-25H,8-9,12H2