1-(4-methylphenyl)sulfonyl-7-(trifluoromethyloxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol

Systemtic Name: 1-(4-methylphenyl)sulfonyl-7-(trifluoromethyloxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol Openeye Name: 1-(p-tolylsulfonyl)-7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol CAS Name: 1-(4-methylphenyl)sulfonyl-7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol IUPAC Name: 1-(4-methylphenyl)sulfonyl-7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol Traditional Name: 1-tosyl-7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepin-5-ol Formula: C18H18F3NO4S MolecularWeight: 401.40003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C3=C2C=CC(=C3)OC(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C3=C2C=CC(=C3)OC(F)(F)F)O

InChI

InChI=1S/C18H18F3NO4S/c1-12-4-7-14(8-5-12)27(24,25)22-10-2-3-17(23)15-11-13(6-9-16(15)22)26-18(19,20)21/h4-9,11,17,23H,2-3,10H2,1H3