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

Systemtic Name: 3-cyclopentyl-1-(2-nitrophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-cyclopentyl-1-(2-nitrophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-cyclopentyl-1-(2-nitrophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-cyclopentyl-1-(2-nitrophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-cyclopentyl-1-(2-nitrophenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=C3CCCCN=C3N(N2)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C2=C3CCCCN=C3N(N2)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O2/c23-22(24)16-11-4-3-10-15(16)21-18-14(9-5-6-12-19-18)17(20-21)13-7-1-2-8-13/h3-4,10-11,13,20H,1-2,5-9,12H2