1-(2,4-dichlorophenyl)-3-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(2,4-dichlorophenyl)-3-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2,4-dichlorophenyl)-3-[2-(1-piperidyl)ethyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2,4-dichlorophenyl)-3-[2-(1-piperidinyl)ethyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2,4-dichlorophenyl)-3-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(2,4-dichlorophenyl)-3-(2-piperidinoethyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C20H26Cl2N4 MolecularWeight: 393.35324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC2=C3CCCCN=C3N(N2)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)CCC2=C3CCCCN=C3N(N2)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H26Cl2N4/c21-15-7-8-19(17(22)14-15)26-20-16(6-2-3-10-23-20)18(24-26)9-13-25-11-4-1-5-12-25/h7-8,14,24H,1-6,9-13H2