N,N-dimethyl-4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]aniline

Systemtic Name: N,N-dimethyl-4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]aniline Openeye Name: N,N-dimethyl-4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]aniline CAS Name: N,N-dimethyl-4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]aniline IUPAC Name: N,N-dimethyl-4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepin-3-yl]aniline Traditional Name: dimethyl-[4-[1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepin-3-yl]phenyl]amine Formula: C22H23F3N4 MolecularWeight: 400.44003

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C3CCCCN=C3N(N2)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C3CCCCN=C3N(N2)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H23F3N4/c1-28(2)17-11-9-15(10-12-17)20-19-8-3-4-13-26-21(19)29(27-20)18-7-5-6-16(14-18)22(23,24)25/h5-7,9-12,14,27H,3-4,8,13H2,1-2H3