1-[3,5-bis(chloranyl)phenyl]-3-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-[3,5-bis(chloranyl)phenyl]-3-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3,5-dichlorophenyl)-3-(2-pyridylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3,5-dichlorophenyl)-3-(2-pyridinylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3,5-dichlorophenyl)-3-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3,5-dichlorophenyl)-3-(2-pyridylmethyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C19H18Cl2N4 MolecularWeight: 373.27902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C3=CC(=CC(=C3)Cl)Cl)CC4=CC=CC=N4)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C3=CC(=CC(=C3)Cl)Cl)CC4=CC=CC=N4)C1

InChI

InChI=1S/C19H18Cl2N4/c20-13-9-14(21)11-16(10-13)25-19-17(6-2-4-8-23-19)18(24-25)12-15-5-1-3-7-22-15/h1,3,5,7,9-11,24H,2,4,6,8,12H2