3-(3-fluorophenyl)-2-pentan-3-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine

Systemtic Name: 3-(3-fluorophenyl)-2-pentan-3-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine Openeye Name: 2-(1-ethylpropyl)-3-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine CAS Name: 3-(3-fluorophenyl)-2-pentan-3-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine IUPAC Name: 3-(3-fluorophenyl)-2-pentan-3-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine Traditional Name: 2-(1-ethylpropyl)-3-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrazol[3,4-d]azepine Formula: C18H24FN3 MolecularWeight: 301.401663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=C2CCNCCC2=N1)C3=CC(=CC=C3)F

Isomeric SMILES

CCC(CC)N1C(=C2CCNCCC2=N1)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H24FN3/c1-3-15(4-2)22-18(13-6-5-7-14(19)12-13)16-8-10-20-11-9-17(16)21-22/h5-7,12,15,20H,3-4,8-11H2,1-2H3