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

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-cyclopentyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-cyclopentyl-1-(2,5-dichlorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-cyclopentyl-1-(2,5-dichlorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-cyclopentyl-1-(2,5-dichlorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-cyclopentyl-1-(2,5-dichlorophenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H21Cl2N3 MolecularWeight: 350.28544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=C3CCCCN=C3N(N2)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1CCC(C1)C2=C3CCCCN=C3N(N2)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C18H21Cl2N3/c19-13-8-9-15(20)16(11-13)23-18-14(7-3-4-10-21-18)17(22-23)12-5-1-2-6-12/h8-9,11-12,22H,1-7,10H2