3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol

Systemtic Name: 3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol Openeye Name: 3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol CAS Name: 3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol IUPAC Name: 3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol Traditional Name: 3-methyl-7-nitro-4-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-8-ol Formula: C18H17F3N2O3 MolecularWeight: 366.33439

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2CC1C3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

CN1CCC2=CC(=C(C=C2CC1C3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C18H17F3N2O3/c1-22-6-5-11-10-17(24)16(23(25)26)9-13(11)8-15(22)12-3-2-4-14(7-12)18(19,20)21/h2-4,7,9-10,15,24H,5-6,8H2,1H3