3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-cyclohexyl-1-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C19H24IN3 MolecularWeight: 421.31843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C3CCCCN=C3N(N2)C4=CC=C(C=C4)I

Isomeric SMILES

C1CCC(CC1)C2=C3CCCCN=C3N(N2)C4=CC=C(C=C4)I

InChI

InChI=1S/C19H24IN3/c20-15-9-11-16(12-10-15)23-19-17(8-4-5-13-21-19)18(22-23)14-6-2-1-3-7-14/h9-12,14,22H,1-8,13H2