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

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-naphthalen-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-(2-naphthyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(4-chloro-2-methylphenyl)-3-(2-naphthalenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-naphthalen-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-(2-naphthyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C24H22ClN3 MolecularWeight: 387.90458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2C3=NCCCCC3=C(N2)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2C3=NCCCCC3=C(N2)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H22ClN3/c1-16-14-20(25)11-12-22(16)28-24-21(8-4-5-13-26-24)23(27-28)19-10-9-17-6-2-3-7-18(17)15-19/h2-3,6-7,9-12,14-15,27H,4-5,8,13H2,1H3