3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine

Systemtic Name: 3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine Openeye Name: 3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine CAS Name: 3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine IUPAC Name: 3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine Traditional Name: 3-(4-chlorophenyl)-1-cyclooctyl-5,6,7,8-tetrahydro-4H-pyrazol[3,4-d]azepine Formula: C21H28ClN3 MolecularWeight: 357.92012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N2C3=C(CCNCC3)C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCC(CCC1)N2C3=C(CCNCC3)C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H28ClN3/c22-17-10-8-16(9-11-17)21-19-12-14-23-15-13-20(19)25(24-21)18-6-4-2-1-3-5-7-18/h8-11,18,23H,1-7,12-15H2